Structure of PDB 7zc6 Chain D Binding Site BS01
Receptor Information
>7zc6 Chain D (length=304) Species:
1553
(Clostridium tetanomorphum) [
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YTVSSSPHIRAKDTTQSIMRDVVIALLPATIAGVYFFKLQGLLVILASVL
SCVVAEYIWQKASKKKVTVGDYSAVVTGLLLAFNVPASIPLWIPVVGGFF
AIIVVKQFFGGLGQNIVNPALAARAFLLASWPVQMTSWTLDGVTTATPLA
ILKGNEATGAAAPDLMSVFIGHVGGCIGETSALALLIGGAYLFYKHIIDW
RIPVSFIGTTFIFTAIAGRGSSPVYELFAGGLMLGAIFMATDYATSPITP
LGRIIFGVGCGVITSLIRIFGGYPEGVSYSILVMNLFVPLIERWTAPKIF
GKVK
Ligand information
Ligand ID
FMN
InChI
InChI=1S/C17H21N4O9P/c1-7-3-9-10(4-8(7)2)21(15-13(18-9)16(25)20-17(26)19-15)5-11(22)14(24)12(23)6-30-31(27,28)29/h3-4,11-12,14,22-24H,5-6H2,1-2H3,(H,20,25,26)(H2,27,28,29)/t11-,12+,14-/m0/s1
InChIKey
FVTCRASFADXXNN-SCRDCRAPSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 1.7.6
Cc1cc2c(cc1C)N(C3=NC(=O)NC(=O)C3=N2)CC(C(C(COP(=O)(O)O)O)O)O
OpenEye OEToolkits 1.7.6
Cc1cc2c(cc1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O
ACDLabs 12.01
N=2C(=O)NC(=O)C3=Nc1cc(C)c(C)cc1N(C=23)CC(O)C(O)C(O)COP(=O)(O)O
CACTVS 3.385
Cc1cc2N=C3C(=O)NC(=O)N=C3N(C[CH](O)[CH](O)[CH](O)CO[P](O)(O)=O)c2cc1C
CACTVS 3.385
Cc1cc2N=C3C(=O)NC(=O)N=C3N(C[C@H](O)[C@H](O)[C@H](O)CO[P](O)(O)=O)c2cc1C
Formula
C17 H21 N4 O9 P
Name
FLAVIN MONONUCLEOTIDE;
RIBOFLAVIN MONOPHOSPHATE
ChEMBL
CHEMBL1201794
DrugBank
DB03247
ZINC
ZINC000003831425
PDB chain
7zc6 Chain D Residue 400 [
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Receptor-Ligand Complex Structure
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PDB
7zc6
Purification and structural characterization of the Na + -translocating ferredoxin: NAD + reductase (Rnf) complex of Clostridium tetanomorphum.
Resolution
4.27 Å
Binding residue
(original residue number in PDB)
R130 W144 T153 C182 E185 G237 P280 E281 V283 S284
Binding residue
(residue number reindexed from 1)
R124 W138 T147 C176 E179 G231 P274 E275 V277 S278
Annotation score
4
Enzymatic activity
Enzyme Commision number
7.-.-.-
Gene Ontology
Biological Process
GO:0022900
electron transport chain
GO:0055085
transmembrane transport
Cellular Component
GO:0005886
plasma membrane
GO:0016020
membrane
View graph for
Biological Process
View graph for
Cellular Component
External links
PDB
RCSB:7zc6
,
PDBe:7zc6
,
PDBj:7zc6
PDBsum
7zc6
PubMed
36274063
UniProt
A0A923IYK2
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