HEADER MEMBRANE PROTEIN 12-NOV-24 9EBA TITLE HUMAN TRPML1 BOUND TO SYBODY57 COMPND MOL_ID: 1; COMPND 2 MOLECULE: SYBODY57; COMPND 3 CHAIN: E, F, G, H; COMPND 4 ENGINEERED: YES; COMPND 5 MOL_ID: 2; COMPND 6 MOLECULE: MUCOLIPIN-1; COMPND 7 CHAIN: A, B, C, D; COMPND 8 SYNONYM: ML1,MG-2,MUCOLIPIDIN,TRANSIENT RECEPTOR POTENTIAL CHANNEL COMPND 9 MUCOLIPIN 1,TRPML1; COMPND 10 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT; SOURCE 3 ORGANISM_TAXID: 32630; SOURCE 4 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 5 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 6 MOL_ID: 2; SOURCE 7 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 8 ORGANISM_COMMON: HUMAN; SOURCE 9 ORGANISM_TAXID: 9606; SOURCE 10 GENE: MCOLN1, ML4, MSTP080; SOURCE 11 EXPRESSION_SYSTEM: HOMO SAPIENS; SOURCE 12 EXPRESSION_SYSTEM_TAXID: 9606 KEYWDS TRPML1, SYBODY, ION CHANNEL, MEMBRANE PROTEIN EXPDTA ELECTRON MICROSCOPY AUTHOR R.P.PUMROY,C.R.CHRISTENSEN,S.P.SALPHATI,V.Y.MOISEENKOVA-BELL, AUTHOR 2 S.NEWSTEAD REVDAT 1 21-JAN-26 9EBA 0 JRNL AUTH S.P.SALPHATI,R.P.PUMROY,C.R.CHRISTENSEN, JRNL AUTH 2 V.Y.MOISEENKOVA-BELL,S.NEWSTEAD JRNL TITL HUMAN TRPML1 BOUND TO SYBODY57 JRNL REF TO BE PUBLISHED JRNL REFN REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH D.LIEBSCHNER,P.V.AFONINE,M.L.BAKER,G.BUNKOCZI,V.B.CHEN, REMARK 1 AUTH 2 T.I.CROLL,B.HINTZE,L.W.HUNG,S.JAIN,A.J.MCCOY,N.W.MORIARTY, REMARK 1 AUTH 3 R.D.OEFFNER,B.K.POON,M.G.PRISANT,R.J.READ,J.S.RICHARDSON, REMARK 1 AUTH 4 D.C.RICHARDSON,M.D.SAMMITO,O.V.SOBOLEV,D.H.STOCKWELL, REMARK 1 AUTH 5 T.C.TERWILLIGER,A.G.URZHUMTSEV,L.L.VIDEAU,C.J.WILLIAMS, REMARK 1 AUTH 6 P.D.ADAMS REMARK 1 TITL MACROMOLECULAR STRUCTURE DETERMINATION USING X-RAYS, REMARK 1 TITL 2 NEUTRONS AND ELECTRONS: RECENT DEVELOPMENTS IN PHENIX REMARK 1 REF ACTA CRYSTALLOGR., SECT. D: V. 75 861 2019 REMARK 1 REF 2 BIOL. CRYSTALLOGR. REMARK 1 REFN ISSN 0907-4449 REMARK 1 PMID 31588918 REMARK 1 DOI 10.1107/S2059798319011471 REMARK 2 REMARK 2 RESOLUTION. 3.10 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 SOFTWARE PACKAGES : PHENIX REMARK 3 RECONSTRUCTION SCHEMA : NULL REMARK 3 REMARK 3 EM MAP-MODEL FITTING AND REFINEMENT REMARK 3 PDB ENTRY : NULL REMARK 3 REFINEMENT SPACE : NULL REMARK 3 REFINEMENT PROTOCOL : NULL REMARK 3 REFINEMENT TARGET : NULL REMARK 3 OVERALL ANISOTROPIC B VALUE : NULL REMARK 3 REMARK 3 FITTING PROCEDURE : NULL REMARK 3 REMARK 3 EM IMAGE RECONSTRUCTION STATISTICS REMARK 3 NOMINAL PIXEL SIZE (ANGSTROMS) : NULL REMARK 3 ACTUAL PIXEL SIZE (ANGSTROMS) : NULL REMARK 3 EFFECTIVE RESOLUTION (ANGSTROMS) : 3.100 REMARK 3 NUMBER OF PARTICLES : 48890 REMARK 3 CTF CORRECTION METHOD : PHASE FLIPPING AND AMPLITUDE REMARK 3 CORRECTION REMARK 3 REMARK 3 EM RECONSTRUCTION MAGNIFICATION CALIBRATION: NULL REMARK 3 REMARK 3 OTHER DETAILS: NULL REMARK 4 REMARK 4 9EBA COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 13-NOV-24. REMARK 100 THE DEPOSITION ID IS D_1000287618. REMARK 245 REMARK 245 EXPERIMENTAL DETAILS REMARK 245 RECONSTRUCTION METHOD : SINGLE PARTICLE REMARK 245 SPECIMEN TYPE : NULL REMARK 245 REMARK 245 ELECTRON MICROSCOPE SAMPLE REMARK 245 SAMPLE TYPE : PARTICLE REMARK 245 PARTICLE TYPE : POINT REMARK 245 NAME OF SAMPLE : COMPLEX OF THE TETRAMERIC REMARK 245 TRPML1 ION CHANNEL BOUND TO REMARK 245 FOUR COPIES OF SYBODY57 REMARK 245 SAMPLE CONCENTRATION (MG ML-1) : NULL REMARK 245 SAMPLE SUPPORT DETAILS : NULL REMARK 245 SAMPLE VITRIFICATION DETAILS : NULL REMARK 245 SAMPLE BUFFER : NULL REMARK 245 PH : 8.00 REMARK 245 SAMPLE DETAILS : NULL REMARK 245 REMARK 245 DATA ACQUISITION REMARK 245 DATE OF EXPERIMENT : NULL REMARK 245 NUMBER OF MICROGRAPHS-IMAGES : NULL REMARK 245 TEMPERATURE (KELVIN) : NULL REMARK 245 MICROSCOPE MODEL : FEI TITAN KRIOS REMARK 245 DETECTOR TYPE : GATAN K3 (6K X 4K) REMARK 245 MINIMUM DEFOCUS (NM) : 8000.00 REMARK 245 MAXIMUM DEFOCUS (NM) : 25000.00 REMARK 245 MINIMUM TILT ANGLE (DEGREES) : NULL REMARK 245 MAXIMUM TILT ANGLE (DEGREES) : NULL REMARK 245 NOMINAL CS : NULL REMARK 245 IMAGING MODE : BRIGHT FIELD REMARK 245 ELECTRON DOSE (ELECTRONS NM**-2) : 4900.00 REMARK 245 ILLUMINATION MODE : FLOOD BEAM REMARK 245 NOMINAL MAGNIFICATION : NULL REMARK 245 CALIBRATED MAGNIFICATION : NULL REMARK 245 SOURCE : FIELD EMISSION GUN REMARK 245 ACCELERATION VOLTAGE (KV) : 300 REMARK 245 IMAGING DETAILS : NULL REMARK 247 REMARK 247 ELECTRON MICROSCOPY REMARK 247 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM ELECTRON REMARK 247 MICROSCOPY DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE REMARK 247 THAT CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES REMARK 247 ON THESE RECORDS ARE MEANINGLESS EXCEPT FOR THE CALCULATION REMARK 247 OF THE STRUCTURE FACTORS. REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: OCTAMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: OCTAMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 APPLY THE FOLLOWING TO CHAINS: E, A, F, G, H, B, C, D REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 GLY E 1 REMARK 465 SER E 2 REMARK 465 SER E 3 REMARK 465 SER E 4 REMARK 465 GLY E 106 REMARK 465 GLU E 107 REMARK 465 ASP E 108 REMARK 465 LYS E 109 REMARK 465 GLU E 110 REMARK 465 LYS E 111 REMARK 465 ALA E 125 REMARK 465 GLY E 126 REMARK 465 ARG E 127 REMARK 465 ALA E 128 REMARK 465 GLY E 129 REMARK 465 GLU E 130 REMARK 465 GLN E 131 REMARK 465 LYS E 132 REMARK 465 LEU E 133 REMARK 465 ILE E 134 REMARK 465 SER E 135 REMARK 465 GLU E 136 REMARK 465 GLU E 137 REMARK 465 ASP E 138 REMARK 465 LEU E 139 REMARK 465 ASN E 140 REMARK 465 SER E 141 REMARK 465 ALA E 142 REMARK 465 VAL E 143 REMARK 465 ASP E 144 REMARK 465 HIS E 145 REMARK 465 HIS E 146 REMARK 465 HIS E 147 REMARK 465 HIS E 148 REMARK 465 HIS E 149 REMARK 465 HIS E 150 REMARK 465 MET A 1 REMARK 465 THR A 2 REMARK 465 ALA A 3 REMARK 465 PRO A 4 REMARK 465 ALA A 5 REMARK 465 GLY A 6 REMARK 465 PRO A 7 REMARK 465 ARG A 8 REMARK 465 GLY A 9 REMARK 465 SER A 10 REMARK 465 GLU A 11 REMARK 465 THR A 12 REMARK 465 GLU A 13 REMARK 465 ARG A 14 REMARK 465 LEU A 15 REMARK 465 LEU A 16 REMARK 465 THR A 17 REMARK 465 PRO A 18 REMARK 465 ASN A 19 REMARK 465 PRO A 20 REMARK 465 GLY A 21 REMARK 465 TYR A 22 REMARK 465 GLY A 23 REMARK 465 THR A 24 REMARK 465 GLN A 25 REMARK 465 ALA A 26 REMARK 465 GLY A 27 REMARK 465 PRO A 28 REMARK 465 SER A 29 REMARK 465 PRO A 30 REMARK 465 ALA A 31 REMARK 465 PRO A 32 REMARK 465 PRO A 33 REMARK 465 THR A 34 REMARK 465 PRO A 35 REMARK 465 PRO A 36 REMARK 465 GLU A 37 REMARK 465 GLU A 38 REMARK 465 GLU A 39 REMARK 465 ASP A 40 REMARK 465 LEU A 41 REMARK 465 ARG A 42 REMARK 465 ARG A 43 REMARK 465 ARG A 44 REMARK 465 GLY A 60 REMARK 465 ARG A 61 REMARK 465 LYS A 62 REMARK 465 ARG A 172 REMARK 465 GLY A 173 REMARK 465 HIS A 174 REMARK 465 VAL A 175 REMARK 465 ASP A 176 REMARK 465 PRO A 177 REMARK 465 ALA A 178 REMARK 465 ASN A 179 REMARK 465 ASP A 180 REMARK 465 THR A 181 REMARK 465 PHE A 182 REMARK 465 ASP A 183 REMARK 465 ILE A 184 REMARK 465 ASP A 185 REMARK 465 GLU A 199 REMARK 465 ARG A 200 REMARK 465 PRO A 201 REMARK 465 PRO A 202 REMARK 465 PRO A 203 REMARK 465 PRO A 204 REMARK 465 PRO A 205 REMARK 465 SER A 206 REMARK 465 ASP A 207 REMARK 465 ASP A 208 REMARK 465 LEU A 209 REMARK 465 THR A 210 REMARK 465 LEU A 211 REMARK 465 LEU A 212 REMARK 465 GLU A 213 REMARK 465 SER A 214 REMARK 465 SER A 215 REMARK 465 SER A 216 REMARK 465 VAL A 289 REMARK 465 PHE A 290 REMARK 465 GLN A 291 REMARK 465 HIS A 292 REMARK 465 TRP A 335 REMARK 465 ARG A 336 REMARK 465 GLN A 337 REMARK 465 ARG A 338 REMARK 465 GLY A 339 REMARK 465 ARG A 340 REMARK 465 VAL A 341 REMARK 465 ILE A 342 REMARK 465 SER A 343 REMARK 465 LEU A 344 REMARK 465 PRO A 527 REMARK 465 GLY A 528 REMARK 465 GLY A 529 REMARK 465 ALA A 530 REMARK 465 GLY A 531 REMARK 465 ALA A 532 REMARK 465 GLU A 533 REMARK 465 GLU A 534 REMARK 465 SER A 535 REMARK 465 GLU A 536 REMARK 465 LEU A 537 REMARK 465 GLN A 538 REMARK 465 ALA A 539 REMARK 465 TYR A 540 REMARK 465 ILE A 541 REMARK 465 ALA A 542 REMARK 465 GLN A 543 REMARK 465 CYS A 544 REMARK 465 GLN A 545 REMARK 465 ASP A 546 REMARK 465 SER A 547 REMARK 465 PRO A 548 REMARK 465 THR A 549 REMARK 465 SER A 550 REMARK 465 GLY A 551 REMARK 465 LYS A 552 REMARK 465 PHE A 553 REMARK 465 ARG A 554 REMARK 465 ARG A 555 REMARK 465 GLY A 556 REMARK 465 SER A 557 REMARK 465 GLY A 558 REMARK 465 SER A 559 REMARK 465 ALA A 560 REMARK 465 CYS A 561 REMARK 465 SER A 562 REMARK 465 LEU A 563 REMARK 465 LEU A 564 REMARK 465 CYS A 565 REMARK 465 CYS A 566 REMARK 465 CYS A 567 REMARK 465 GLY A 568 REMARK 465 ARG A 569 REMARK 465 ASP A 570 REMARK 465 PRO A 571 REMARK 465 SER A 572 REMARK 465 GLU A 573 REMARK 465 GLU A 574 REMARK 465 HIS A 575 REMARK 465 SER A 576 REMARK 465 LEU A 577 REMARK 465 LEU A 578 REMARK 465 VAL A 579 REMARK 465 ASN A 580 REMARK 465 GLY F 1 REMARK 465 SER F 2 REMARK 465 SER F 3 REMARK 465 SER F 4 REMARK 465 GLY F 106 REMARK 465 GLU F 107 REMARK 465 ASP F 108 REMARK 465 LYS F 109 REMARK 465 GLU F 110 REMARK 465 LYS F 111 REMARK 465 ALA F 125 REMARK 465 GLY F 126 REMARK 465 ARG F 127 REMARK 465 ALA F 128 REMARK 465 GLY F 129 REMARK 465 GLU F 130 REMARK 465 GLN F 131 REMARK 465 LYS F 132 REMARK 465 LEU F 133 REMARK 465 ILE F 134 REMARK 465 SER F 135 REMARK 465 GLU F 136 REMARK 465 GLU F 137 REMARK 465 ASP F 138 REMARK 465 LEU F 139 REMARK 465 ASN F 140 REMARK 465 SER F 141 REMARK 465 ALA F 142 REMARK 465 VAL F 143 REMARK 465 ASP F 144 REMARK 465 HIS F 145 REMARK 465 HIS F 146 REMARK 465 HIS F 147 REMARK 465 HIS F 148 REMARK 465 HIS F 149 REMARK 465 HIS F 150 REMARK 465 GLY G 1 REMARK 465 SER G 2 REMARK 465 SER G 3 REMARK 465 SER G 4 REMARK 465 GLY G 106 REMARK 465 GLU G 107 REMARK 465 ASP G 108 REMARK 465 LYS G 109 REMARK 465 GLU G 110 REMARK 465 LYS G 111 REMARK 465 ALA G 125 REMARK 465 GLY G 126 REMARK 465 ARG G 127 REMARK 465 ALA G 128 REMARK 465 GLY G 129 REMARK 465 GLU G 130 REMARK 465 GLN G 131 REMARK 465 LYS G 132 REMARK 465 LEU G 133 REMARK 465 ILE G 134 REMARK 465 SER G 135 REMARK 465 GLU G 136 REMARK 465 GLU G 137 REMARK 465 ASP G 138 REMARK 465 LEU G 139 REMARK 465 ASN G 140 REMARK 465 SER G 141 REMARK 465 ALA G 142 REMARK 465 VAL G 143 REMARK 465 ASP G 144 REMARK 465 HIS G 145 REMARK 465 HIS G 146 REMARK 465 HIS G 147 REMARK 465 HIS G 148 REMARK 465 HIS G 149 REMARK 465 HIS G 150 REMARK 465 GLY H 1 REMARK 465 SER H 2 REMARK 465 SER H 3 REMARK 465 SER H 4 REMARK 465 GLY H 106 REMARK 465 GLU H 107 REMARK 465 ASP H 108 REMARK 465 LYS H 109 REMARK 465 GLU H 110 REMARK 465 LYS H 111 REMARK 465 ALA H 125 REMARK 465 GLY H 126 REMARK 465 ARG H 127 REMARK 465 ALA H 128 REMARK 465 GLY H 129 REMARK 465 GLU H 130 REMARK 465 GLN H 131 REMARK 465 LYS H 132 REMARK 465 LEU H 133 REMARK 465 ILE H 134 REMARK 465 SER H 135 REMARK 465 GLU H 136 REMARK 465 GLU H 137 REMARK 465 ASP H 138 REMARK 465 LEU H 139 REMARK 465 ASN H 140 REMARK 465 SER H 141 REMARK 465 ALA H 142 REMARK 465 VAL H 143 REMARK 465 ASP H 144 REMARK 465 HIS H 145 REMARK 465 HIS H 146 REMARK 465 HIS H 147 REMARK 465 HIS H 148 REMARK 465 HIS H 149 REMARK 465 HIS H 150 REMARK 465 MET B 1 REMARK 465 THR B 2 REMARK 465 ALA B 3 REMARK 465 PRO B 4 REMARK 465 ALA B 5 REMARK 465 GLY B 6 REMARK 465 PRO B 7 REMARK 465 ARG B 8 REMARK 465 GLY B 9 REMARK 465 SER B 10 REMARK 465 GLU B 11 REMARK 465 THR B 12 REMARK 465 GLU B 13 REMARK 465 ARG B 14 REMARK 465 LEU B 15 REMARK 465 LEU B 16 REMARK 465 THR B 17 REMARK 465 PRO B 18 REMARK 465 ASN B 19 REMARK 465 PRO B 20 REMARK 465 GLY B 21 REMARK 465 TYR B 22 REMARK 465 GLY B 23 REMARK 465 THR B 24 REMARK 465 GLN B 25 REMARK 465 ALA B 26 REMARK 465 GLY B 27 REMARK 465 PRO B 28 REMARK 465 SER B 29 REMARK 465 PRO B 30 REMARK 465 ALA B 31 REMARK 465 PRO B 32 REMARK 465 PRO B 33 REMARK 465 THR B 34 REMARK 465 PRO B 35 REMARK 465 PRO B 36 REMARK 465 GLU B 37 REMARK 465 GLU B 38 REMARK 465 GLU B 39 REMARK 465 ASP B 40 REMARK 465 LEU B 41 REMARK 465 ARG B 42 REMARK 465 ARG B 43 REMARK 465 ARG B 44 REMARK 465 GLY B 60 REMARK 465 ARG B 61 REMARK 465 LYS B 62 REMARK 465 ARG B 172 REMARK 465 GLY B 173 REMARK 465 HIS B 174 REMARK 465 VAL B 175 REMARK 465 ASP B 176 REMARK 465 PRO B 177 REMARK 465 ALA B 178 REMARK 465 ASN B 179 REMARK 465 ASP B 180 REMARK 465 THR B 181 REMARK 465 PHE B 182 REMARK 465 ASP B 183 REMARK 465 ILE B 184 REMARK 465 ASP B 185 REMARK 465 GLU B 199 REMARK 465 ARG B 200 REMARK 465 PRO B 201 REMARK 465 PRO B 202 REMARK 465 PRO B 203 REMARK 465 PRO B 204 REMARK 465 PRO B 205 REMARK 465 SER B 206 REMARK 465 ASP B 207 REMARK 465 ASP B 208 REMARK 465 LEU B 209 REMARK 465 THR B 210 REMARK 465 LEU B 211 REMARK 465 LEU B 212 REMARK 465 GLU B 213 REMARK 465 SER B 214 REMARK 465 SER B 215 REMARK 465 SER B 216 REMARK 465 VAL B 289 REMARK 465 PHE B 290 REMARK 465 GLN B 291 REMARK 465 HIS B 292 REMARK 465 TRP B 335 REMARK 465 ARG B 336 REMARK 465 GLN B 337 REMARK 465 ARG B 338 REMARK 465 GLY B 339 REMARK 465 ARG B 340 REMARK 465 VAL B 341 REMARK 465 ILE B 342 REMARK 465 SER B 343 REMARK 465 LEU B 344 REMARK 465 PRO B 527 REMARK 465 GLY B 528 REMARK 465 GLY B 529 REMARK 465 ALA B 530 REMARK 465 GLY B 531 REMARK 465 ALA B 532 REMARK 465 GLU B 533 REMARK 465 GLU B 534 REMARK 465 SER B 535 REMARK 465 GLU B 536 REMARK 465 LEU B 537 REMARK 465 GLN B 538 REMARK 465 ALA B 539 REMARK 465 TYR B 540 REMARK 465 ILE B 541 REMARK 465 ALA B 542 REMARK 465 GLN B 543 REMARK 465 CYS B 544 REMARK 465 GLN B 545 REMARK 465 ASP B 546 REMARK 465 SER B 547 REMARK 465 PRO B 548 REMARK 465 THR B 549 REMARK 465 SER B 550 REMARK 465 GLY B 551 REMARK 465 LYS B 552 REMARK 465 PHE B 553 REMARK 465 ARG B 554 REMARK 465 ARG B 555 REMARK 465 GLY B 556 REMARK 465 SER B 557 REMARK 465 GLY B 558 REMARK 465 SER B 559 REMARK 465 ALA B 560 REMARK 465 CYS B 561 REMARK 465 SER B 562 REMARK 465 LEU B 563 REMARK 465 LEU B 564 REMARK 465 CYS B 565 REMARK 465 CYS B 566 REMARK 465 CYS B 567 REMARK 465 GLY B 568 REMARK 465 ARG B 569 REMARK 465 ASP B 570 REMARK 465 PRO B 571 REMARK 465 SER B 572 REMARK 465 GLU B 573 REMARK 465 GLU B 574 REMARK 465 HIS B 575 REMARK 465 SER B 576 REMARK 465 LEU B 577 REMARK 465 LEU B 578 REMARK 465 VAL B 579 REMARK 465 ASN B 580 REMARK 465 MET C 1 REMARK 465 THR C 2 REMARK 465 ALA C 3 REMARK 465 PRO C 4 REMARK 465 ALA C 5 REMARK 465 GLY C 6 REMARK 465 PRO C 7 REMARK 465 ARG C 8 REMARK 465 GLY C 9 REMARK 465 SER C 10 REMARK 465 GLU C 11 REMARK 465 THR C 12 REMARK 465 GLU C 13 REMARK 465 ARG C 14 REMARK 465 LEU C 15 REMARK 465 LEU C 16 REMARK 465 THR C 17 REMARK 465 PRO C 18 REMARK 465 ASN C 19 REMARK 465 PRO C 20 REMARK 465 GLY C 21 REMARK 465 TYR C 22 REMARK 465 GLY C 23 REMARK 465 THR C 24 REMARK 465 GLN C 25 REMARK 465 ALA C 26 REMARK 465 GLY C 27 REMARK 465 PRO C 28 REMARK 465 SER C 29 REMARK 465 PRO C 30 REMARK 465 ALA C 31 REMARK 465 PRO C 32 REMARK 465 PRO C 33 REMARK 465 THR C 34 REMARK 465 PRO C 35 REMARK 465 PRO C 36 REMARK 465 GLU C 37 REMARK 465 GLU C 38 REMARK 465 GLU C 39 REMARK 465 ASP C 40 REMARK 465 LEU C 41 REMARK 465 ARG C 42 REMARK 465 ARG C 43 REMARK 465 ARG C 44 REMARK 465 GLY C 60 REMARK 465 ARG C 61 REMARK 465 LYS C 62 REMARK 465 ARG C 172 REMARK 465 GLY C 173 REMARK 465 HIS C 174 REMARK 465 VAL C 175 REMARK 465 ASP C 176 REMARK 465 PRO C 177 REMARK 465 ALA C 178 REMARK 465 ASN C 179 REMARK 465 ASP C 180 REMARK 465 THR C 181 REMARK 465 PHE C 182 REMARK 465 ASP C 183 REMARK 465 ILE C 184 REMARK 465 ASP C 185 REMARK 465 GLU C 199 REMARK 465 ARG C 200 REMARK 465 PRO C 201 REMARK 465 PRO C 202 REMARK 465 PRO C 203 REMARK 465 PRO C 204 REMARK 465 PRO C 205 REMARK 465 SER C 206 REMARK 465 ASP C 207 REMARK 465 ASP C 208 REMARK 465 LEU C 209 REMARK 465 THR C 210 REMARK 465 LEU C 211 REMARK 465 LEU C 212 REMARK 465 GLU C 213 REMARK 465 SER C 214 REMARK 465 SER C 215 REMARK 465 SER C 216 REMARK 465 VAL C 289 REMARK 465 PHE C 290 REMARK 465 GLN C 291 REMARK 465 HIS C 292 REMARK 465 TRP C 335 REMARK 465 ARG C 336 REMARK 465 GLN C 337 REMARK 465 ARG C 338 REMARK 465 GLY C 339 REMARK 465 ARG C 340 REMARK 465 VAL C 341 REMARK 465 ILE C 342 REMARK 465 SER C 343 REMARK 465 LEU C 344 REMARK 465 PRO C 527 REMARK 465 GLY C 528 REMARK 465 GLY C 529 REMARK 465 ALA C 530 REMARK 465 GLY C 531 REMARK 465 ALA C 532 REMARK 465 GLU C 533 REMARK 465 GLU C 534 REMARK 465 SER C 535 REMARK 465 GLU C 536 REMARK 465 LEU C 537 REMARK 465 GLN C 538 REMARK 465 ALA C 539 REMARK 465 TYR C 540 REMARK 465 ILE C 541 REMARK 465 ALA C 542 REMARK 465 GLN C 543 REMARK 465 CYS C 544 REMARK 465 GLN C 545 REMARK 465 ASP C 546 REMARK 465 SER C 547 REMARK 465 PRO C 548 REMARK 465 THR C 549 REMARK 465 SER C 550 REMARK 465 GLY C 551 REMARK 465 LYS C 552 REMARK 465 PHE C 553 REMARK 465 ARG C 554 REMARK 465 ARG C 555 REMARK 465 GLY C 556 REMARK 465 SER C 557 REMARK 465 GLY C 558 REMARK 465 SER C 559 REMARK 465 ALA C 560 REMARK 465 CYS C 561 REMARK 465 SER C 562 REMARK 465 LEU C 563 REMARK 465 LEU C 564 REMARK 465 CYS C 565 REMARK 465 CYS C 566 REMARK 465 CYS C 567 REMARK 465 GLY C 568 REMARK 465 ARG C 569 REMARK 465 ASP C 570 REMARK 465 PRO C 571 REMARK 465 SER C 572 REMARK 465 GLU C 573 REMARK 465 GLU C 574 REMARK 465 HIS C 575 REMARK 465 SER C 576 REMARK 465 LEU C 577 REMARK 465 LEU C 578 REMARK 465 VAL C 579 REMARK 465 ASN C 580 REMARK 465 MET D 1 REMARK 465 THR D 2 REMARK 465 ALA D 3 REMARK 465 PRO D 4 REMARK 465 ALA D 5 REMARK 465 GLY D 6 REMARK 465 PRO D 7 REMARK 465 ARG D 8 REMARK 465 GLY D 9 REMARK 465 SER D 10 REMARK 465 GLU D 11 REMARK 465 THR D 12 REMARK 465 GLU D 13 REMARK 465 ARG D 14 REMARK 465 LEU D 15 REMARK 465 LEU D 16 REMARK 465 THR D 17 REMARK 465 PRO D 18 REMARK 465 ASN D 19 REMARK 465 PRO D 20 REMARK 465 GLY D 21 REMARK 465 TYR D 22 REMARK 465 GLY D 23 REMARK 465 THR D 24 REMARK 465 GLN D 25 REMARK 465 ALA D 26 REMARK 465 GLY D 27 REMARK 465 PRO D 28 REMARK 465 SER D 29 REMARK 465 PRO D 30 REMARK 465 ALA D 31 REMARK 465 PRO D 32 REMARK 465 PRO D 33 REMARK 465 THR D 34 REMARK 465 PRO D 35 REMARK 465 PRO D 36 REMARK 465 GLU D 37 REMARK 465 GLU D 38 REMARK 465 GLU D 39 REMARK 465 ASP D 40 REMARK 465 LEU D 41 REMARK 465 ARG D 42 REMARK 465 ARG D 43 REMARK 465 ARG D 44 REMARK 465 GLY D 60 REMARK 465 ARG D 61 REMARK 465 LYS D 62 REMARK 465 ARG D 172 REMARK 465 GLY D 173 REMARK 465 HIS D 174 REMARK 465 VAL D 175 REMARK 465 ASP D 176 REMARK 465 PRO D 177 REMARK 465 ALA D 178 REMARK 465 ASN D 179 REMARK 465 ASP D 180 REMARK 465 THR D 181 REMARK 465 PHE D 182 REMARK 465 ASP D 183 REMARK 465 ILE D 184 REMARK 465 ASP D 185 REMARK 465 GLU D 199 REMARK 465 ARG D 200 REMARK 465 PRO D 201 REMARK 465 PRO D 202 REMARK 465 PRO D 203 REMARK 465 PRO D 204 REMARK 465 PRO D 205 REMARK 465 SER D 206 REMARK 465 ASP D 207 REMARK 465 ASP D 208 REMARK 465 LEU D 209 REMARK 465 THR D 210 REMARK 465 LEU D 211 REMARK 465 LEU D 212 REMARK 465 GLU D 213 REMARK 465 SER D 214 REMARK 465 SER D 215 REMARK 465 SER D 216 REMARK 465 VAL D 289 REMARK 465 PHE D 290 REMARK 465 GLN D 291 REMARK 465 HIS D 292 REMARK 465 TRP D 335 REMARK 465 ARG D 336 REMARK 465 GLN D 337 REMARK 465 ARG D 338 REMARK 465 GLY D 339 REMARK 465 ARG D 340 REMARK 465 VAL D 341 REMARK 465 ILE D 342 REMARK 465 SER D 343 REMARK 465 LEU D 344 REMARK 465 PRO D 527 REMARK 465 GLY D 528 REMARK 465 GLY D 529 REMARK 465 ALA D 530 REMARK 465 GLY D 531 REMARK 465 ALA D 532 REMARK 465 GLU D 533 REMARK 465 GLU D 534 REMARK 465 SER D 535 REMARK 465 GLU D 536 REMARK 465 LEU D 537 REMARK 465 GLN D 538 REMARK 465 ALA D 539 REMARK 465 TYR D 540 REMARK 465 ILE D 541 REMARK 465 ALA D 542 REMARK 465 GLN D 543 REMARK 465 CYS D 544 REMARK 465 GLN D 545 REMARK 465 ASP D 546 REMARK 465 SER D 547 REMARK 465 PRO D 548 REMARK 465 THR D 549 REMARK 465 SER D 550 REMARK 465 GLY D 551 REMARK 465 LYS D 552 REMARK 465 PHE D 553 REMARK 465 ARG D 554 REMARK 465 ARG D 555 REMARK 465 GLY D 556 REMARK 465 SER D 557 REMARK 465 GLY D 558 REMARK 465 SER D 559 REMARK 465 ALA D 560 REMARK 465 CYS D 561 REMARK 465 SER D 562 REMARK 465 LEU D 563 REMARK 465 LEU D 564 REMARK 465 CYS D 565 REMARK 465 CYS D 566 REMARK 465 CYS D 567 REMARK 465 GLY D 568 REMARK 465 ARG D 569 REMARK 465 ASP D 570 REMARK 465 PRO D 571 REMARK 465 SER D 572 REMARK 465 GLU D 573 REMARK 465 GLU D 574 REMARK 465 HIS D 575 REMARK 465 SER D 576 REMARK 465 LEU D 577 REMARK 465 LEU D 578 REMARK 465 VAL D 579 REMARK 465 ASN D 580 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 LEU A 45 CG CD1 CD2 REMARK 470 LYS A 46 CG CD CE NZ REMARK 470 ARG A 57 CG CD NE CZ NH1 NH2 REMARK 470 LYS A 59 CG CD CE NZ REMARK 470 ASP A 115 CG OD1 OD2 REMARK 470 ASN A 247 CG OD1 ND2 REMARK 470 ASN A 248 CG OD1 ND2 REMARK 470 GLU A 249 CG CD OE1 OE2 REMARK 470 TRP A 345 CG CD1 CD2 NE1 CE2 CE3 CZ2 REMARK 470 TRP A 345 CZ3 CH2 REMARK 470 GLU A 346 CG CD OE1 OE2 REMARK 470 ARG A 347 CG CD NE CZ NH1 NH2 REMARK 470 LEU B 45 CG CD1 CD2 REMARK 470 LYS B 46 CG CD CE NZ REMARK 470 ARG B 57 CG CD NE CZ NH1 NH2 REMARK 470 LYS B 59 CG CD CE NZ REMARK 470 ASP B 115 CG OD1 OD2 REMARK 470 ASN B 247 CG OD1 ND2 REMARK 470 ASN B 248 CG OD1 ND2 REMARK 470 GLU B 249 CG CD OE1 OE2 REMARK 470 TRP B 345 CG CD1 CD2 NE1 CE2 CE3 CZ2 REMARK 470 TRP B 345 CZ3 CH2 REMARK 470 GLU B 346 CG CD OE1 OE2 REMARK 470 ARG B 347 CG CD NE CZ NH1 NH2 REMARK 470 LEU C 45 CG CD1 CD2 REMARK 470 LYS C 46 CG CD CE NZ REMARK 470 ARG C 57 CG CD NE CZ NH1 NH2 REMARK 470 LYS C 59 CG CD CE NZ REMARK 470 ASP C 115 CG OD1 OD2 REMARK 470 ASN C 247 CG OD1 ND2 REMARK 470 ASN C 248 CG OD1 ND2 REMARK 470 GLU C 249 CG CD OE1 OE2 REMARK 470 TRP C 345 CG CD1 CD2 NE1 CE2 CE3 CZ2 REMARK 470 TRP C 345 CZ3 CH2 REMARK 470 GLU C 346 CG CD OE1 OE2 REMARK 470 ARG C 347 CG CD NE CZ NH1 NH2 REMARK 470 LEU D 45 CG CD1 CD2 REMARK 470 LYS D 46 CG CD CE NZ REMARK 470 ARG D 57 CG CD NE CZ NH1 NH2 REMARK 470 LYS D 59 CG CD CE NZ REMARK 470 ASP D 115 CG OD1 OD2 REMARK 470 ASN D 247 CG OD1 ND2 REMARK 470 ASN D 248 CG OD1 ND2 REMARK 470 GLU D 249 CG CD OE1 OE2 REMARK 470 TRP D 345 CG CD1 CD2 NE1 CE2 CE3 CZ2 REMARK 470 TRP D 345 CZ3 CH2 REMARK 470 GLU D 346 CG CD OE1 OE2 REMARK 470 ARG D 347 CG CD NE CZ NH1 NH2 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 VAL E 52 -53.36 -121.49 REMARK 500 VAL F 52 -53.40 -121.52 REMARK 500 VAL G 52 -53.34 -121.53 REMARK 500 VAL H 52 -53.42 -121.46 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: EMD-47875 RELATED DB: EMDB REMARK 900 HUMAN TRPML1 BOUND TO SYBODY57 DBREF 9EBA E 1 150 PDB 9EBA 9EBA 1 150 DBREF 9EBA A 1 580 UNP Q9GZU1 MCLN1_HUMAN 1 580 DBREF 9EBA F 1 150 PDB 9EBA 9EBA 1 150 DBREF 9EBA G 1 150 PDB 9EBA 9EBA 1 150 DBREF 9EBA H 1 150 PDB 9EBA 9EBA 1 150 DBREF 9EBA B 1 580 UNP Q9GZU1 MCLN1_HUMAN 1 580 DBREF 9EBA C 1 580 UNP Q9GZU1 MCLN1_HUMAN 1 580 DBREF 9EBA D 1 580 UNP Q9GZU1 MCLN1_HUMAN 1 580 SEQRES 1 E 150 GLY SER SER SER GLN VAL GLN LEU VAL GLU SER GLY GLY SEQRES 2 E 150 GLY LEU VAL GLN ALA GLY GLY SER LEU ARG LEU SER CYS SEQRES 3 E 150 ALA ALA SER GLY PHE PRO VAL ASN ALA VAL TRP MET HIS SEQRES 4 E 150 TRP TYR ARG GLN ALA PRO GLY LYS GLU ARG GLU TRP VAL SEQRES 5 E 150 ALA ALA ILE ARG SER TYR GLY TRP TYR THR TRP TYR ALA SEQRES 6 E 150 ASP SER VAL LYS GLY ARG PHE THR ILE SER ARG ASP ASN SEQRES 7 E 150 ALA LYS ASN THR VAL TYR LEU GLN MET ASN SER LEU LYS SEQRES 8 E 150 PRO GLU ASP ALA ALA VAL TYR TYR CYS ASN VAL LYS ASP SEQRES 9 E 150 THR GLY GLU ASP LYS GLU LYS TYR ASP TYR TRP GLY GLN SEQRES 10 E 150 GLY THR GLN VAL THR VAL SER ALA GLY ARG ALA GLY GLU SEQRES 11 E 150 GLN LYS LEU ILE SER GLU GLU ASP LEU ASN SER ALA VAL SEQRES 12 E 150 ASP HIS HIS HIS HIS HIS HIS SEQRES 1 A 580 MET THR ALA PRO ALA GLY PRO ARG GLY SER GLU THR GLU SEQRES 2 A 580 ARG LEU LEU THR PRO ASN PRO GLY TYR GLY THR GLN ALA SEQRES 3 A 580 GLY PRO SER PRO ALA PRO PRO THR PRO PRO GLU GLU GLU SEQRES 4 A 580 ASP LEU ARG ARG ARG LEU LYS TYR PHE PHE MET SER PRO SEQRES 5 A 580 CYS ASP LYS PHE ARG ALA LYS GLY ARG LYS PRO CYS LYS SEQRES 6 A 580 LEU MET LEU GLN VAL VAL LYS ILE LEU VAL VAL THR VAL SEQRES 7 A 580 GLN LEU ILE LEU PHE GLY LEU SER ASN GLN LEU ALA VAL SEQRES 8 A 580 THR PHE ARG GLU GLU ASN THR ILE ALA PHE ARG HIS LEU SEQRES 9 A 580 PHE LEU LEU GLY TYR SER ASP GLY ALA ASP ASP THR PHE SEQRES 10 A 580 ALA ALA TYR THR ARG GLU GLN LEU TYR GLN ALA ILE PHE SEQRES 11 A 580 HIS ALA VAL ASP GLN TYR LEU ALA LEU PRO ASP VAL SER SEQRES 12 A 580 LEU GLY ARG TYR ALA TYR VAL ARG GLY GLY GLY ASP PRO SEQRES 13 A 580 TRP THR ASN GLY SER GLY LEU ALA LEU CYS GLN ARG TYR SEQRES 14 A 580 TYR HIS ARG GLY HIS VAL ASP PRO ALA ASN ASP THR PHE SEQRES 15 A 580 ASP ILE ASP PRO MET VAL VAL THR ASP CYS ILE GLN VAL SEQRES 16 A 580 ASP PRO PRO GLU ARG PRO PRO PRO PRO PRO SER ASP ASP SEQRES 17 A 580 LEU THR LEU LEU GLU SER SER SER SER TYR LYS ASN LEU SEQRES 18 A 580 THR LEU LYS PHE HIS LYS LEU VAL ASN VAL THR ILE HIS SEQRES 19 A 580 PHE ARG LEU LYS THR ILE ASN LEU GLN SER LEU ILE ASN SEQRES 20 A 580 ASN GLU ILE PRO ASP CYS TYR THR PHE SER VAL LEU ILE SEQRES 21 A 580 THR PHE ASP ASN LYS ALA HIS SER GLY ARG ILE PRO ILE SEQRES 22 A 580 SER LEU GLU THR GLN ALA HIS ILE GLN GLU CYS LYS HIS SEQRES 23 A 580 PRO SER VAL PHE GLN HIS GLY ASP ASN SER PHE ARG LEU SEQRES 24 A 580 LEU PHE ASP VAL VAL VAL ILE LEU THR CYS SER LEU SER SEQRES 25 A 580 PHE LEU LEU CYS ALA ARG SER LEU LEU ARG GLY PHE LEU SEQRES 26 A 580 LEU GLN ASN GLU PHE VAL GLY PHE MET TRP ARG GLN ARG SEQRES 27 A 580 GLY ARG VAL ILE SER LEU TRP GLU ARG LEU GLU PHE VAL SEQRES 28 A 580 ASN GLY TRP TYR ILE LEU LEU VAL THR SER ASP VAL LEU SEQRES 29 A 580 THR ILE SER GLY THR ILE MET LYS ILE GLY ILE GLU ALA SEQRES 30 A 580 LYS ASN LEU ALA SER TYR ASP VAL CYS SER ILE LEU LEU SEQRES 31 A 580 GLY THR SER THR LEU LEU VAL TRP VAL GLY VAL ILE ARG SEQRES 32 A 580 TYR LEU THR PHE PHE HIS ASN TYR ASN ILE LEU ILE ALA SEQRES 33 A 580 THR LEU ARG VAL ALA LEU PRO SER VAL MET ARG PHE CYS SEQRES 34 A 580 CYS CYS VAL ALA VAL ILE TYR LEU GLY TYR CYS PHE CYS SEQRES 35 A 580 GLY TRP ILE VAL LEU GLY PRO TYR HIS VAL LYS PHE ARG SEQRES 36 A 580 SER LEU SER MET VAL SER GLU CYS LEU PHE SER LEU ILE SEQRES 37 A 580 ASN GLY ASP ASP MET PHE VAL THR PHE ALA ALA MET GLN SEQRES 38 A 580 ALA GLN GLN GLY ARG SER SER LEU VAL TRP LEU PHE SER SEQRES 39 A 580 GLN LEU TYR LEU TYR SER PHE ILE SER LEU PHE ILE TYR SEQRES 40 A 580 MET VAL LEU SER LEU PHE ILE ALA LEU ILE THR GLY ALA SEQRES 41 A 580 TYR ASP THR ILE LYS HIS PRO GLY GLY ALA GLY ALA GLU SEQRES 42 A 580 GLU SER GLU LEU GLN ALA TYR ILE ALA GLN CYS GLN ASP SEQRES 43 A 580 SER PRO THR SER GLY LYS PHE ARG ARG GLY SER GLY SER SEQRES 44 A 580 ALA CYS SER LEU LEU CYS CYS CYS GLY ARG ASP PRO SER SEQRES 45 A 580 GLU GLU HIS SER LEU LEU VAL ASN SEQRES 1 F 150 GLY SER SER SER GLN VAL GLN LEU VAL GLU SER GLY GLY SEQRES 2 F 150 GLY LEU VAL GLN ALA GLY GLY SER LEU ARG LEU SER CYS SEQRES 3 F 150 ALA ALA SER GLY PHE PRO VAL ASN ALA VAL TRP MET HIS SEQRES 4 F 150 TRP TYR ARG GLN ALA PRO GLY LYS GLU ARG GLU TRP VAL SEQRES 5 F 150 ALA ALA ILE ARG SER TYR GLY TRP TYR THR TRP TYR ALA SEQRES 6 F 150 ASP SER VAL LYS GLY ARG PHE THR ILE SER ARG ASP ASN SEQRES 7 F 150 ALA LYS ASN THR VAL TYR LEU GLN MET ASN SER LEU LYS SEQRES 8 F 150 PRO GLU ASP ALA ALA VAL TYR TYR CYS ASN VAL LYS ASP SEQRES 9 F 150 THR GLY GLU ASP LYS GLU LYS TYR ASP TYR TRP GLY GLN SEQRES 10 F 150 GLY THR GLN VAL THR VAL SER ALA GLY ARG ALA GLY GLU SEQRES 11 F 150 GLN LYS LEU ILE SER GLU GLU ASP LEU ASN SER ALA VAL SEQRES 12 F 150 ASP HIS HIS HIS HIS HIS HIS SEQRES 1 G 150 GLY SER SER SER GLN VAL GLN LEU VAL GLU SER GLY GLY SEQRES 2 G 150 GLY LEU VAL GLN ALA GLY GLY SER LEU ARG LEU SER CYS SEQRES 3 G 150 ALA ALA SER GLY PHE PRO VAL ASN ALA VAL TRP MET HIS SEQRES 4 G 150 TRP TYR ARG GLN ALA PRO GLY LYS GLU ARG GLU TRP VAL SEQRES 5 G 150 ALA ALA ILE ARG SER TYR GLY TRP TYR THR TRP TYR ALA SEQRES 6 G 150 ASP SER VAL LYS GLY ARG PHE THR ILE SER ARG ASP ASN SEQRES 7 G 150 ALA LYS ASN THR VAL TYR LEU GLN MET ASN SER LEU LYS SEQRES 8 G 150 PRO GLU ASP ALA ALA VAL TYR TYR CYS ASN VAL LYS ASP SEQRES 9 G 150 THR GLY GLU ASP LYS GLU LYS TYR ASP TYR TRP GLY GLN SEQRES 10 G 150 GLY THR GLN VAL THR VAL SER ALA GLY ARG ALA GLY GLU SEQRES 11 G 150 GLN LYS LEU ILE SER GLU GLU ASP LEU ASN SER ALA VAL SEQRES 12 G 150 ASP HIS HIS HIS HIS HIS HIS SEQRES 1 H 150 GLY SER SER SER GLN VAL GLN LEU VAL GLU SER GLY GLY SEQRES 2 H 150 GLY LEU VAL GLN ALA GLY GLY SER LEU ARG LEU SER CYS SEQRES 3 H 150 ALA ALA SER GLY PHE PRO VAL ASN ALA VAL TRP MET HIS SEQRES 4 H 150 TRP TYR ARG GLN ALA PRO GLY LYS GLU ARG GLU TRP VAL SEQRES 5 H 150 ALA ALA ILE ARG SER TYR GLY TRP TYR THR TRP TYR ALA SEQRES 6 H 150 ASP SER VAL LYS GLY ARG PHE THR ILE SER ARG ASP ASN SEQRES 7 H 150 ALA LYS ASN THR VAL TYR LEU GLN MET ASN SER LEU LYS SEQRES 8 H 150 PRO GLU ASP ALA ALA VAL TYR TYR CYS ASN VAL LYS ASP SEQRES 9 H 150 THR GLY GLU ASP LYS GLU LYS TYR ASP TYR TRP GLY GLN SEQRES 10 H 150 GLY THR GLN VAL THR VAL SER ALA GLY ARG ALA GLY GLU SEQRES 11 H 150 GLN LYS LEU ILE SER GLU GLU ASP LEU ASN SER ALA VAL SEQRES 12 H 150 ASP HIS HIS HIS HIS HIS HIS SEQRES 1 B 580 MET THR ALA PRO ALA GLY PRO ARG GLY SER GLU THR GLU SEQRES 2 B 580 ARG LEU LEU THR PRO ASN PRO GLY TYR GLY THR GLN ALA SEQRES 3 B 580 GLY PRO SER PRO ALA PRO PRO THR PRO PRO GLU GLU GLU SEQRES 4 B 580 ASP LEU ARG ARG ARG LEU LYS TYR PHE PHE MET SER PRO SEQRES 5 B 580 CYS ASP LYS PHE ARG ALA LYS GLY ARG LYS PRO CYS LYS SEQRES 6 B 580 LEU MET LEU GLN VAL VAL LYS ILE LEU VAL VAL THR VAL SEQRES 7 B 580 GLN LEU ILE LEU PHE GLY LEU SER ASN GLN LEU ALA VAL SEQRES 8 B 580 THR PHE ARG GLU GLU ASN THR ILE ALA PHE ARG HIS LEU SEQRES 9 B 580 PHE LEU LEU GLY TYR SER ASP GLY ALA ASP ASP THR PHE SEQRES 10 B 580 ALA ALA TYR THR ARG GLU GLN LEU TYR GLN ALA ILE PHE SEQRES 11 B 580 HIS ALA VAL ASP GLN TYR LEU ALA LEU PRO ASP VAL SER SEQRES 12 B 580 LEU GLY ARG TYR ALA TYR VAL ARG GLY GLY GLY ASP PRO SEQRES 13 B 580 TRP THR ASN GLY SER GLY LEU ALA LEU CYS GLN ARG TYR SEQRES 14 B 580 TYR HIS ARG GLY HIS VAL ASP PRO ALA ASN ASP THR PHE SEQRES 15 B 580 ASP ILE ASP PRO MET VAL VAL THR ASP CYS ILE GLN VAL SEQRES 16 B 580 ASP PRO PRO GLU ARG PRO PRO PRO PRO PRO SER ASP ASP SEQRES 17 B 580 LEU THR LEU LEU GLU SER SER SER SER TYR LYS ASN LEU SEQRES 18 B 580 THR LEU LYS PHE HIS LYS LEU VAL ASN VAL THR ILE HIS SEQRES 19 B 580 PHE ARG LEU LYS THR ILE ASN LEU GLN SER LEU ILE ASN SEQRES 20 B 580 ASN GLU ILE PRO ASP CYS TYR THR PHE SER VAL LEU ILE SEQRES 21 B 580 THR PHE ASP ASN LYS ALA HIS SER GLY ARG ILE PRO ILE SEQRES 22 B 580 SER LEU GLU THR GLN ALA HIS ILE GLN GLU CYS LYS HIS SEQRES 23 B 580 PRO SER VAL PHE GLN HIS GLY ASP ASN SER PHE ARG LEU SEQRES 24 B 580 LEU PHE ASP VAL VAL VAL ILE LEU THR CYS SER LEU SER SEQRES 25 B 580 PHE LEU LEU CYS ALA ARG SER LEU LEU ARG GLY PHE LEU SEQRES 26 B 580 LEU GLN ASN GLU PHE VAL GLY PHE MET TRP ARG GLN ARG SEQRES 27 B 580 GLY ARG VAL ILE SER LEU TRP GLU ARG LEU GLU PHE VAL SEQRES 28 B 580 ASN GLY TRP TYR ILE LEU LEU VAL THR SER ASP VAL LEU SEQRES 29 B 580 THR ILE SER GLY THR ILE MET LYS ILE GLY ILE GLU ALA SEQRES 30 B 580 LYS ASN LEU ALA SER TYR ASP VAL CYS SER ILE LEU LEU SEQRES 31 B 580 GLY THR SER THR LEU LEU VAL TRP VAL GLY VAL ILE ARG SEQRES 32 B 580 TYR LEU THR PHE PHE HIS ASN TYR ASN ILE LEU ILE ALA SEQRES 33 B 580 THR LEU ARG VAL ALA LEU PRO SER VAL MET ARG PHE CYS SEQRES 34 B 580 CYS CYS VAL ALA VAL ILE TYR LEU GLY TYR CYS PHE CYS SEQRES 35 B 580 GLY TRP ILE VAL LEU GLY PRO TYR HIS VAL LYS PHE ARG SEQRES 36 B 580 SER LEU SER MET VAL SER GLU CYS LEU PHE SER LEU ILE SEQRES 37 B 580 ASN GLY ASP ASP MET PHE VAL THR PHE ALA ALA MET GLN SEQRES 38 B 580 ALA GLN GLN GLY ARG SER SER LEU VAL TRP LEU PHE SER SEQRES 39 B 580 GLN LEU TYR LEU TYR SER PHE ILE SER LEU PHE ILE TYR SEQRES 40 B 580 MET VAL LEU SER LEU PHE ILE ALA LEU ILE THR GLY ALA SEQRES 41 B 580 TYR ASP THR ILE LYS HIS PRO GLY GLY ALA GLY ALA GLU SEQRES 42 B 580 GLU SER GLU LEU GLN ALA TYR ILE ALA GLN CYS GLN ASP SEQRES 43 B 580 SER PRO THR SER GLY LYS PHE ARG ARG GLY SER GLY SER SEQRES 44 B 580 ALA CYS SER LEU LEU CYS CYS CYS GLY ARG ASP PRO SER SEQRES 45 B 580 GLU GLU HIS SER LEU LEU VAL ASN SEQRES 1 C 580 MET THR ALA PRO ALA GLY PRO ARG GLY SER GLU THR GLU SEQRES 2 C 580 ARG LEU LEU THR PRO ASN PRO GLY TYR GLY THR GLN ALA SEQRES 3 C 580 GLY PRO SER PRO ALA PRO PRO THR PRO PRO GLU GLU GLU SEQRES 4 C 580 ASP LEU ARG ARG ARG LEU LYS TYR PHE PHE MET SER PRO SEQRES 5 C 580 CYS ASP LYS PHE ARG ALA LYS GLY ARG LYS PRO CYS LYS SEQRES 6 C 580 LEU MET LEU GLN VAL VAL LYS ILE LEU VAL VAL THR VAL SEQRES 7 C 580 GLN LEU ILE LEU PHE GLY LEU SER ASN GLN LEU ALA VAL SEQRES 8 C 580 THR PHE ARG GLU GLU ASN THR ILE ALA PHE ARG HIS LEU SEQRES 9 C 580 PHE LEU LEU GLY TYR SER ASP GLY ALA ASP ASP THR PHE SEQRES 10 C 580 ALA ALA TYR THR ARG GLU GLN LEU TYR GLN ALA ILE PHE SEQRES 11 C 580 HIS ALA VAL ASP GLN TYR LEU ALA LEU PRO ASP VAL SER SEQRES 12 C 580 LEU GLY ARG TYR ALA TYR VAL ARG GLY GLY GLY ASP PRO SEQRES 13 C 580 TRP THR ASN GLY SER GLY LEU ALA LEU CYS GLN ARG TYR SEQRES 14 C 580 TYR HIS ARG GLY HIS VAL ASP PRO ALA ASN ASP THR PHE SEQRES 15 C 580 ASP ILE ASP PRO MET VAL VAL THR ASP CYS ILE GLN VAL SEQRES 16 C 580 ASP PRO PRO GLU ARG PRO PRO PRO PRO PRO SER ASP ASP SEQRES 17 C 580 LEU THR LEU LEU GLU SER SER SER SER TYR LYS ASN LEU SEQRES 18 C 580 THR LEU LYS PHE HIS LYS LEU VAL ASN VAL THR ILE HIS SEQRES 19 C 580 PHE ARG LEU LYS THR ILE ASN LEU GLN SER LEU ILE ASN SEQRES 20 C 580 ASN GLU ILE PRO ASP CYS TYR THR PHE SER VAL LEU ILE SEQRES 21 C 580 THR PHE ASP ASN LYS ALA HIS SER GLY ARG ILE PRO ILE SEQRES 22 C 580 SER LEU GLU THR GLN ALA HIS ILE GLN GLU CYS LYS HIS SEQRES 23 C 580 PRO SER VAL PHE GLN HIS GLY ASP ASN SER PHE ARG LEU SEQRES 24 C 580 LEU PHE ASP VAL VAL VAL ILE LEU THR CYS SER LEU SER SEQRES 25 C 580 PHE LEU LEU CYS ALA ARG SER LEU LEU ARG GLY PHE LEU SEQRES 26 C 580 LEU GLN ASN GLU PHE VAL GLY PHE MET TRP ARG GLN ARG SEQRES 27 C 580 GLY ARG VAL ILE SER LEU TRP GLU ARG LEU GLU PHE VAL SEQRES 28 C 580 ASN GLY TRP TYR ILE LEU LEU VAL THR SER ASP VAL LEU SEQRES 29 C 580 THR ILE SER GLY THR ILE MET LYS ILE GLY ILE GLU ALA SEQRES 30 C 580 LYS ASN LEU ALA SER TYR ASP VAL CYS SER ILE LEU LEU SEQRES 31 C 580 GLY THR SER THR LEU LEU VAL TRP VAL GLY VAL ILE ARG SEQRES 32 C 580 TYR LEU THR PHE PHE HIS ASN TYR ASN ILE LEU ILE ALA SEQRES 33 C 580 THR LEU ARG VAL ALA LEU PRO SER VAL MET ARG PHE CYS SEQRES 34 C 580 CYS CYS VAL ALA VAL ILE TYR LEU GLY TYR CYS PHE CYS SEQRES 35 C 580 GLY TRP ILE VAL LEU GLY PRO TYR HIS VAL LYS PHE ARG SEQRES 36 C 580 SER LEU SER MET VAL SER GLU CYS LEU PHE SER LEU ILE SEQRES 37 C 580 ASN GLY ASP ASP MET PHE VAL THR PHE ALA ALA MET GLN SEQRES 38 C 580 ALA GLN GLN GLY ARG SER SER LEU VAL TRP LEU PHE SER SEQRES 39 C 580 GLN LEU TYR LEU TYR SER PHE ILE SER LEU PHE ILE TYR SEQRES 40 C 580 MET VAL LEU SER LEU PHE ILE ALA LEU ILE THR GLY ALA SEQRES 41 C 580 TYR ASP THR ILE LYS HIS PRO GLY GLY ALA GLY ALA GLU SEQRES 42 C 580 GLU SER GLU LEU GLN ALA TYR ILE ALA GLN CYS GLN ASP SEQRES 43 C 580 SER PRO THR SER GLY LYS PHE ARG ARG GLY SER GLY SER SEQRES 44 C 580 ALA CYS SER LEU LEU CYS CYS CYS GLY ARG ASP PRO SER SEQRES 45 C 580 GLU GLU HIS SER LEU LEU VAL ASN SEQRES 1 D 580 MET THR ALA PRO ALA GLY PRO ARG GLY SER GLU THR GLU SEQRES 2 D 580 ARG LEU LEU THR PRO ASN PRO GLY TYR GLY THR GLN ALA SEQRES 3 D 580 GLY PRO SER PRO ALA PRO PRO THR PRO PRO GLU GLU GLU SEQRES 4 D 580 ASP LEU ARG ARG ARG LEU LYS TYR PHE PHE MET SER PRO SEQRES 5 D 580 CYS ASP LYS PHE ARG ALA LYS GLY ARG LYS PRO CYS LYS SEQRES 6 D 580 LEU MET LEU GLN VAL VAL LYS ILE LEU VAL VAL THR VAL SEQRES 7 D 580 GLN LEU ILE LEU PHE GLY LEU SER ASN GLN LEU ALA VAL SEQRES 8 D 580 THR PHE ARG GLU GLU ASN THR ILE ALA PHE ARG HIS LEU SEQRES 9 D 580 PHE LEU LEU GLY TYR SER ASP GLY ALA ASP ASP THR PHE SEQRES 10 D 580 ALA ALA TYR THR ARG GLU GLN LEU TYR GLN ALA ILE PHE SEQRES 11 D 580 HIS ALA VAL ASP GLN TYR LEU ALA LEU PRO ASP VAL SER SEQRES 12 D 580 LEU GLY ARG TYR ALA TYR VAL ARG GLY GLY GLY ASP PRO SEQRES 13 D 580 TRP THR ASN GLY SER GLY LEU ALA LEU CYS GLN ARG TYR SEQRES 14 D 580 TYR HIS ARG GLY HIS VAL ASP PRO ALA ASN ASP THR PHE SEQRES 15 D 580 ASP ILE ASP PRO MET VAL VAL THR ASP CYS ILE GLN VAL SEQRES 16 D 580 ASP PRO PRO GLU ARG PRO PRO PRO PRO PRO SER ASP ASP SEQRES 17 D 580 LEU THR LEU LEU GLU SER SER SER SER TYR LYS ASN LEU SEQRES 18 D 580 THR LEU LYS PHE HIS LYS LEU VAL ASN VAL THR ILE HIS SEQRES 19 D 580 PHE ARG LEU LYS THR ILE ASN LEU GLN SER LEU ILE ASN SEQRES 20 D 580 ASN GLU ILE PRO ASP CYS TYR THR PHE SER VAL LEU ILE SEQRES 21 D 580 THR PHE ASP ASN LYS ALA HIS SER GLY ARG ILE PRO ILE SEQRES 22 D 580 SER LEU GLU THR GLN ALA HIS ILE GLN GLU CYS LYS HIS SEQRES 23 D 580 PRO SER VAL PHE GLN HIS GLY ASP ASN SER PHE ARG LEU SEQRES 24 D 580 LEU PHE ASP VAL VAL VAL ILE LEU THR CYS SER LEU SER SEQRES 25 D 580 PHE LEU LEU CYS ALA ARG SER LEU LEU ARG GLY PHE LEU SEQRES 26 D 580 LEU GLN ASN GLU PHE VAL GLY PHE MET TRP ARG GLN ARG SEQRES 27 D 580 GLY ARG VAL ILE SER LEU TRP GLU ARG LEU GLU PHE VAL SEQRES 28 D 580 ASN GLY TRP TYR ILE LEU LEU VAL THR SER ASP VAL LEU SEQRES 29 D 580 THR ILE SER GLY THR ILE MET LYS ILE GLY ILE GLU ALA SEQRES 30 D 580 LYS ASN LEU ALA SER TYR ASP VAL CYS SER ILE LEU LEU SEQRES 31 D 580 GLY THR SER THR LEU LEU VAL TRP VAL GLY VAL ILE ARG SEQRES 32 D 580 TYR LEU THR PHE PHE HIS ASN TYR ASN ILE LEU ILE ALA SEQRES 33 D 580 THR LEU ARG VAL ALA LEU PRO SER VAL MET ARG PHE CYS SEQRES 34 D 580 CYS CYS VAL ALA VAL ILE TYR LEU GLY TYR CYS PHE CYS SEQRES 35 D 580 GLY TRP ILE VAL LEU GLY PRO TYR HIS VAL LYS PHE ARG SEQRES 36 D 580 SER LEU SER MET VAL SER GLU CYS LEU PHE SER LEU ILE SEQRES 37 D 580 ASN GLY ASP ASP MET PHE VAL THR PHE ALA ALA MET GLN SEQRES 38 D 580 ALA GLN GLN GLY ARG SER SER LEU VAL TRP LEU PHE SER SEQRES 39 D 580 GLN LEU TYR LEU TYR SER PHE ILE SER LEU PHE ILE TYR SEQRES 40 D 580 MET VAL LEU SER LEU PHE ILE ALA LEU ILE THR GLY ALA SEQRES 41 D 580 TYR ASP THR ILE LYS HIS PRO GLY GLY ALA GLY ALA GLU SEQRES 42 D 580 GLU SER GLU LEU GLN ALA TYR ILE ALA GLN CYS GLN ASP SEQRES 43 D 580 SER PRO THR SER GLY LYS PHE ARG ARG GLY SER GLY SER SEQRES 44 D 580 ALA CYS SER LEU LEU CYS CYS CYS GLY ARG ASP PRO SER SEQRES 45 D 580 GLU GLU HIS SER LEU LEU VAL ASN HET EUJ A 601 47 HET EUJ B 601 47 HET EUJ C 601 47 HET EUJ D 601 47 HETNAM EUJ (2R)-3-{[(S)-HYDROXY{[(1S,2R,3R,4S,5S,6R)-2,4,6- HETNAM 2 EUJ TRIHYDROXY-3,5-BIS(PHOSPHONOOXY) HETNAM 3 EUJ CYCLOHEXYL]OXY}PHOSPHORYL]OXY}PROPANE-1,2-DIYL HETNAM 4 EUJ DIOCTANOATE FORMUL 9 EUJ 4(C25 H49 O19 P3) HELIX 1 AA1 PRO E 32 VAL E 36 5 5 HELIX 2 AA2 SER A 51 LYS A 59 1 9 HELIX 3 AA3 CYS A 64 LEU A 106 1 43 HELIX 4 AA4 THR A 121 ALA A 138 1 18 HELIX 5 AA5 ALA A 138 SER A 143 1 6 HELIX 6 AA6 SER A 217 LEU A 221 5 5 HELIX 7 AA7 LYS A 224 HIS A 226 5 3 HELIX 8 AA8 ASN A 241 ASN A 247 1 7 HELIX 9 AA9 ASN A 295 MET A 334 1 40 HELIX 10 AB1 TRP A 345 PHE A 350 5 6 HELIX 11 AB2 ASN A 352 GLY A 374 1 23 HELIX 12 AB3 ASN A 379 GLY A 400 1 22 HELIX 13 AB4 VAL A 401 PHE A 407 1 7 HELIX 14 AB5 ASN A 410 LEU A 447 1 38 HELIX 15 AB6 HIS A 451 ARG A 455 5 5 HELIX 16 AB7 SER A 456 GLY A 470 1 15 HELIX 17 AB8 ASP A 472 MET A 480 1 9 HELIX 18 AB9 GLN A 481 GLN A 484 5 4 HELIX 19 AC1 SER A 487 MET A 508 1 22 HELIX 20 AC2 MET A 508 HIS A 526 1 19 HELIX 21 AC3 PRO F 32 VAL F 36 5 5 HELIX 22 AC4 PRO G 32 VAL G 36 5 5 HELIX 23 AC5 PRO H 32 VAL H 36 5 5 HELIX 24 AC6 SER B 51 LYS B 59 1 9 HELIX 25 AC7 CYS B 64 LEU B 106 1 43 HELIX 26 AC8 THR B 121 ALA B 138 1 18 HELIX 27 AC9 ALA B 138 SER B 143 1 6 HELIX 28 AD1 SER B 217 LEU B 221 5 5 HELIX 29 AD2 LYS B 224 HIS B 226 5 3 HELIX 30 AD3 ASN B 241 ASN B 247 1 7 HELIX 31 AD4 ASN B 295 MET B 334 1 40 HELIX 32 AD5 TRP B 345 PHE B 350 5 6 HELIX 33 AD6 ASN B 352 GLY B 374 1 23 HELIX 34 AD7 ASN B 379 GLY B 400 1 22 HELIX 35 AD8 VAL B 401 PHE B 407 1 7 HELIX 36 AD9 ASN B 410 LEU B 447 1 38 HELIX 37 AE1 HIS B 451 ARG B 455 5 5 HELIX 38 AE2 SER B 456 GLY B 470 1 15 HELIX 39 AE3 ASP B 472 MET B 480 1 9 HELIX 40 AE4 GLN B 481 GLN B 484 5 4 HELIX 41 AE5 SER B 487 MET B 508 1 22 HELIX 42 AE6 MET B 508 HIS B 526 1 19 HELIX 43 AE7 SER C 51 LYS C 59 1 9 HELIX 44 AE8 CYS C 64 LEU C 106 1 43 HELIX 45 AE9 THR C 121 ALA C 138 1 18 HELIX 46 AF1 ALA C 138 SER C 143 1 6 HELIX 47 AF2 SER C 217 LEU C 221 5 5 HELIX 48 AF3 LYS C 224 HIS C 226 5 3 HELIX 49 AF4 ASN C 241 ASN C 247 1 7 HELIX 50 AF5 ASN C 295 MET C 334 1 40 HELIX 51 AF6 TRP C 345 PHE C 350 5 6 HELIX 52 AF7 ASN C 352 GLY C 374 1 23 HELIX 53 AF8 ASN C 379 GLY C 400 1 22 HELIX 54 AF9 VAL C 401 PHE C 407 1 7 HELIX 55 AG1 ASN C 410 LEU C 447 1 38 HELIX 56 AG2 HIS C 451 ARG C 455 5 5 HELIX 57 AG3 SER C 456 GLY C 470 1 15 HELIX 58 AG4 ASP C 472 MET C 480 1 9 HELIX 59 AG5 GLN C 481 GLN C 484 5 4 HELIX 60 AG6 SER C 487 MET C 508 1 22 HELIX 61 AG7 MET C 508 HIS C 526 1 19 HELIX 62 AG8 SER D 51 LYS D 59 1 9 HELIX 63 AG9 CYS D 64 LEU D 106 1 43 HELIX 64 AH1 THR D 121 ALA D 138 1 18 HELIX 65 AH2 ALA D 138 SER D 143 1 6 HELIX 66 AH3 SER D 217 LEU D 221 5 5 HELIX 67 AH4 LYS D 224 HIS D 226 5 3 HELIX 68 AH5 ASN D 241 ASN D 247 1 7 HELIX 69 AH6 ASN D 295 MET D 334 1 40 HELIX 70 AH7 TRP D 345 PHE D 350 5 6 HELIX 71 AH8 ASN D 352 GLY D 374 1 23 HELIX 72 AH9 ASN D 379 GLY D 400 1 22 HELIX 73 AI1 VAL D 401 PHE D 407 1 7 HELIX 74 AI2 ASN D 410 LEU D 447 1 38 HELIX 75 AI3 HIS D 451 ARG D 455 5 5 HELIX 76 AI4 SER D 456 GLY D 470 1 15 HELIX 77 AI5 ASP D 472 MET D 480 1 9 HELIX 78 AI6 GLN D 481 GLN D 484 5 4 HELIX 79 AI7 SER D 487 MET D 508 1 22 HELIX 80 AI8 MET D 508 HIS D 526 1 19 SHEET 1 AA1 4 GLN E 7 SER E 11 0 SHEET 2 AA1 4 LEU E 22 SER E 29 -1 O ALA E 27 N VAL E 9 SHEET 3 AA1 4 THR E 82 MET E 87 -1 O MET E 87 N LEU E 22 SHEET 4 AA1 4 THR E 73 ASP E 77 -1 N THR E 73 O GLN E 86 SHEET 1 AA2 6 GLY E 14 VAL E 16 0 SHEET 2 AA2 6 THR E 119 VAL E 123 1 O GLN E 120 N GLY E 14 SHEET 3 AA2 6 VAL E 97 TYR E 99 -1 N TYR E 98 O THR E 119 SHEET 4 AA2 6 HIS E 39 GLN E 43 -1 N TYR E 41 O TYR E 99 SHEET 5 AA2 6 GLU E 50 ILE E 55 -1 O ALA E 53 N TRP E 40 SHEET 6 AA2 6 THR E 62 TYR E 64 -1 O TRP E 63 N ALA E 54 SHEET 1 AA3 5 ALA A 118 ALA A 119 0 SHEET 2 AA3 5 ILE A 271 GLN A 278 -1 O ILE A 271 N ALA A 119 SHEET 3 AA3 5 THR A 255 ASP A 263 -1 N ASP A 263 O PRO A 272 SHEET 4 AA3 5 LEU A 228 LYS A 238 -1 N VAL A 231 O PHE A 262 SHEET 5 AA3 5 ALA A 148 TYR A 149 -1 N ALA A 148 O LYS A 238 SHEET 1 AA4 6 ALA A 118 ALA A 119 0 SHEET 2 AA4 6 ILE A 271 GLN A 278 -1 O ILE A 271 N ALA A 119 SHEET 3 AA4 6 THR A 255 ASP A 263 -1 N ASP A 263 O PRO A 272 SHEET 4 AA4 6 LEU A 228 LYS A 238 -1 N VAL A 231 O PHE A 262 SHEET 5 AA4 6 LEU A 163 TYR A 170 -1 N CYS A 166 O THR A 232 SHEET 6 AA4 6 VAL A 188 VAL A 195 -1 O VAL A 189 N TYR A 169 SHEET 1 AA5 2 ASP A 252 CYS A 253 0 SHEET 2 AA5 2 GLN A 282 GLU A 283 -1 O GLN A 282 N CYS A 253 SHEET 1 AA6 4 GLN F 7 SER F 11 0 SHEET 2 AA6 4 LEU F 22 SER F 29 -1 O ALA F 27 N VAL F 9 SHEET 3 AA6 4 THR F 82 MET F 87 -1 O MET F 87 N LEU F 22 SHEET 4 AA6 4 THR F 73 ASP F 77 -1 N THR F 73 O GLN F 86 SHEET 1 AA7 6 GLY F 14 VAL F 16 0 SHEET 2 AA7 6 THR F 119 VAL F 123 1 O GLN F 120 N GLY F 14 SHEET 3 AA7 6 VAL F 97 TYR F 99 -1 N TYR F 98 O THR F 119 SHEET 4 AA7 6 HIS F 39 GLN F 43 -1 N TYR F 41 O TYR F 99 SHEET 5 AA7 6 GLU F 50 ILE F 55 -1 O ALA F 53 N TRP F 40 SHEET 6 AA7 6 THR F 62 TYR F 64 -1 O TRP F 63 N ALA F 54 SHEET 1 AA8 4 GLN G 7 SER G 11 0 SHEET 2 AA8 4 LEU G 22 SER G 29 -1 O ALA G 27 N VAL G 9 SHEET 3 AA8 4 THR G 82 MET G 87 -1 O MET G 87 N LEU G 22 SHEET 4 AA8 4 THR G 73 ASP G 77 -1 N THR G 73 O GLN G 86 SHEET 1 AA9 6 GLY G 14 VAL G 16 0 SHEET 2 AA9 6 THR G 119 VAL G 123 1 O GLN G 120 N GLY G 14 SHEET 3 AA9 6 VAL G 97 TYR G 99 -1 N TYR G 98 O THR G 119 SHEET 4 AA9 6 HIS G 39 GLN G 43 -1 N TYR G 41 O TYR G 99 SHEET 5 AA9 6 GLU G 50 ILE G 55 -1 O ALA G 53 N TRP G 40 SHEET 6 AA9 6 THR G 62 TYR G 64 -1 O TRP G 63 N ALA G 54 SHEET 1 AB1 4 GLN H 7 SER H 11 0 SHEET 2 AB1 4 LEU H 22 SER H 29 -1 O ALA H 27 N VAL H 9 SHEET 3 AB1 4 THR H 82 MET H 87 -1 O MET H 87 N LEU H 22 SHEET 4 AB1 4 THR H 73 ASP H 77 -1 N THR H 73 O GLN H 86 SHEET 1 AB2 6 GLY H 14 VAL H 16 0 SHEET 2 AB2 6 THR H 119 VAL H 123 1 O GLN H 120 N GLY H 14 SHEET 3 AB2 6 VAL H 97 TYR H 99 -1 N TYR H 98 O THR H 119 SHEET 4 AB2 6 HIS H 39 GLN H 43 -1 N TYR H 41 O TYR H 99 SHEET 5 AB2 6 GLU H 50 ILE H 55 -1 O ALA H 53 N TRP H 40 SHEET 6 AB2 6 THR H 62 TYR H 64 -1 O TRP H 63 N ALA H 54 SHEET 1 AB3 5 ALA B 118 ALA B 119 0 SHEET 2 AB3 5 ILE B 271 GLN B 278 -1 O ILE B 271 N ALA B 119 SHEET 3 AB3 5 THR B 255 ASP B 263 -1 N ASP B 263 O PRO B 272 SHEET 4 AB3 5 LEU B 228 LYS B 238 -1 N VAL B 231 O PHE B 262 SHEET 5 AB3 5 ALA B 148 TYR B 149 -1 N ALA B 148 O LYS B 238 SHEET 1 AB4 6 ALA B 118 ALA B 119 0 SHEET 2 AB4 6 ILE B 271 GLN B 278 -1 O ILE B 271 N ALA B 119 SHEET 3 AB4 6 THR B 255 ASP B 263 -1 N ASP B 263 O PRO B 272 SHEET 4 AB4 6 LEU B 228 LYS B 238 -1 N VAL B 231 O PHE B 262 SHEET 5 AB4 6 LEU B 163 TYR B 170 -1 N CYS B 166 O THR B 232 SHEET 6 AB4 6 VAL B 188 VAL B 195 -1 O VAL B 189 N TYR B 169 SHEET 1 AB5 2 ASP B 252 CYS B 253 0 SHEET 2 AB5 2 GLN B 282 GLU B 283 -1 O GLN B 282 N CYS B 253 SHEET 1 AB6 5 ALA C 118 ALA C 119 0 SHEET 2 AB6 5 ILE C 271 GLN C 278 -1 O ILE C 271 N ALA C 119 SHEET 3 AB6 5 THR C 255 ASP C 263 -1 N ASP C 263 O PRO C 272 SHEET 4 AB6 5 LEU C 228 LYS C 238 -1 N VAL C 231 O PHE C 262 SHEET 5 AB6 5 ALA C 148 TYR C 149 -1 N ALA C 148 O LYS C 238 SHEET 1 AB7 6 ALA C 118 ALA C 119 0 SHEET 2 AB7 6 ILE C 271 GLN C 278 -1 O ILE C 271 N ALA C 119 SHEET 3 AB7 6 THR C 255 ASP C 263 -1 N ASP C 263 O PRO C 272 SHEET 4 AB7 6 LEU C 228 LYS C 238 -1 N VAL C 231 O PHE C 262 SHEET 5 AB7 6 LEU C 163 TYR C 170 -1 N CYS C 166 O THR C 232 SHEET 6 AB7 6 VAL C 188 VAL C 195 -1 O VAL C 189 N TYR C 169 SHEET 1 AB8 2 ASP C 252 CYS C 253 0 SHEET 2 AB8 2 GLN C 282 GLU C 283 -1 O GLN C 282 N CYS C 253 SHEET 1 AB9 5 ALA D 118 ALA D 119 0 SHEET 2 AB9 5 ILE D 271 GLN D 278 -1 O ILE D 271 N ALA D 119 SHEET 3 AB9 5 THR D 255 ASP D 263 -1 N ASP D 263 O PRO D 272 SHEET 4 AB9 5 LEU D 228 LYS D 238 -1 N VAL D 231 O PHE D 262 SHEET 5 AB9 5 ALA D 148 TYR D 149 -1 N ALA D 148 O LYS D 238 SHEET 1 AC1 6 ALA D 118 ALA D 119 0 SHEET 2 AC1 6 ILE D 271 GLN D 278 -1 O ILE D 271 N ALA D 119 SHEET 3 AC1 6 THR D 255 ASP D 263 -1 N ASP D 263 O PRO D 272 SHEET 4 AC1 6 LEU D 228 LYS D 238 -1 N VAL D 231 O PHE D 262 SHEET 5 AC1 6 LEU D 163 TYR D 170 -1 N CYS D 166 O THR D 232 SHEET 6 AC1 6 VAL D 188 VAL D 195 -1 O VAL D 189 N TYR D 169 SHEET 1 AC2 2 ASP D 252 CYS D 253 0 SHEET 2 AC2 2 GLN D 282 GLU D 283 -1 O GLN D 282 N CYS D 253 SSBOND 1 CYS E 26 CYS E 100 1555 1555 2.03 SSBOND 2 CYS F 26 CYS F 100 1555 1555 2.03 SSBOND 3 CYS G 26 CYS G 100 1555 1555 2.03 SSBOND 4 CYS H 26 CYS H 100 1555 1555 2.03 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 0.00000