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Structure of PDB 6nin Chain O Binding Site BS03

Receptor Information >6nin Chain O (length=428) Species: 272943 (Cereibacter sphaeroides 2.4.1) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure] GIPHDHYEPRTGIEKWLHSRLPIVALAYDTIMIPTPRNLNWMWIWGVVLA FCLVLQIVTGIVLAMHYTPHVDLAFASVEHIMRNVNGGFMLRYLHANGAS LFFIAVYLHIFRGLYYGSYKAPREVTWIVGMLIYLAMMATAFMGYVLPWG QMSFWGATVITGLFGAIPGIGHSIQTWLLGGPCVDNATLNRFFSLHYLLP FVIAALVAIHIWAFHSTGNNNPTGVEVRRTSKAEAQKDTVPFWPYFIIKD VFALAVVLLVFFAIVGFMPNYLGHPDNYIEANPLSTPAHIVPEWYFLPFY AILRAFTADVWVVQIANFISFGIIDAKFFGVLAMFGAILVMALVPWLDTS PVRSGRYRPMFKIYFWLLAADFVILTWVGAQQTTFPYDWISLIASAYWFA YFLVILPILGAIEKPVAPPATIEEDFNA

Ligand information Ligand ID SMA InChI InChI=1S/C30H42O7/c1-10-18(2)13-11-12-14-22(33-6)21(5)29(36-9)19(3)15-16-23-20(4)27(31)26-24(34-7)17-25(35-8)28(32)30(26)37-23/h10-14,17,19,21-22,29,32H,15-16H2,1-9H3/b13-11+,14-12?,18-10+/t19-,21+,22-,29-/m0/s1 InChIKey UZHDGDDPOPDJGM-WPPYOTIYSA-N SMILES Software SMILES OpenEye OEToolkits 1.7.2 C/C=C(\C)/C=C/C=C[C@@H]([C@@H](C)[C@H]([C@@H](C)CCC1=C(C(=O)c2c(cc(c(c2O1)O)OC)OC)C)OC)OC CACTVS 3.370 CO[CH](C=CC=CC(C)=CC)[CH](C)[CH](OC)[CH](C)CCC1=C(C)C(=O)c2c(OC)cc(OC)c(O)c2O1 OpenEye OEToolkits 1.7.2 CC=C(C)C=CC=CC(C(C)C(C(C)CCC1=C(C(=O)c2c(cc(c(c2O1)O)OC)OC)C)OC)OC CACTVS 3.370 CO[C@@H](\C=C\C=C\C(C)=C\C)[C@@H](C)[C@@H](OC)[C@@H](C)CCC1=C(C)C(=O)c2c(OC)cc(OC)c(O)c2O1 Formula C30 H42 O7 Name STIGMATELLIN A ChEMBL DrugBank ZINC PDB chain 6nin Chain O Residue 1003 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]

Receptor-Ligand Complex Structure Global view Local view Structure summary [Spin on] [Spin off] [Reset] [High quality] [Low quality] [White background] [Black background] [Spin on] [Spin off] [Reset] [High quality] [Low quality] [White background] [Black background] PDB 6nin Crystal structure of bacterial cytochromebc1in complex with azoxystrobin reveals a conformational switch of the Rieske iron-sulfur protein subunit. Resolution 3.6 Å Binding residue (original residue number in PDB) M140 F144 M145 G158 V161 I162 F166 P294 E295 F298 Y302 M336 Binding residue (residue number reindexed from 1) M138 F142 M143 G156 V159 I160 F164 P292 E293 F296 Y300 M334 Annotation score 1

Enzymatic activity Catalytic site (original residue number in PDB) H217 N221 K251 D252 E295 Catalytic site (residue number reindexed from 1) H215 N219 K249 D250 E293 Enzyme Commision number ?

Gene Ontology Molecular Function GO:0008121 ubiquinol-cytochrome-c reductase activity GO:0009055 electron transfer activity GO:0016491 oxidoreductase activity GO:0046872 metal ion binding

	Biological Process
GO:0022904	respiratory electron transport chain
GO:1902600	proton transmembrane transport

	Cellular Component
GO:0005886	plasma membrane
GO:0016020	membrane
GO:0045275	respiratory chain complex III

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