Structure of PDB 7wmk Chain A Binding Site BS02

Receptor Information
>7wmk Chain A (length=557) Species: 429726 (Devosia albogilva) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ADGAAAETAAPGQSAIENFQPVTAEDLAGGNAANWPILRGNYQGWGYTQL
DQINKDNVGQLQLAWARTMEPGSNEGSAIAYNGVVFLGNANDVVQAIDGK
TGNLIWEYRRKLPPASKFINSLGAAKRSIALFGDKVYFVSWDNFVVALDA
KTGKLAWETNRGQGVEEGVSNSSGPIVVDGVVIAGSTCQYSGFGCYVTGT
DAESGEELWRNTFIPRPGEEGDDTWGGAPYENRWMTGAWGQITYDPELDL
VYYGSTGAGPASEVQRGTEGGTLAGTNTRFAVKPKTGEVVWKHQTLPRDN
WDSECTFEMMVVSTTVNPDAGADGMMSVGANVPRGETRKVLTGVPCKTGV
AWQFDAETGDYFWSKATVEQNSIASIDDKGLVTVNEDMILKEPGKDYNYC
PTFLGGRDWPSAGYLPKSNLYVIPLSNACYDLVKLAPGKTNMGRVDAIDV
ATGATKWSFETEAALYDPVMTTAGDLVFVGSTDRMFRALDAETGKEVWST
RLPGAISGYTTSYSIDGRQYVAVVAGGSLGTGFFKAAVPGVDAVQGGNGI
YVFALPE
Ligand information
Ligand IDCA
InChIInChI=1S/Ca/q+2
InChIKeyBHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Ca+2]
FormulaCa
NameCALCIUM ION
ChEMBL
DrugBankDB14577
ZINC
PDB chain7wmk Chain A Residue 606 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7wmk Structure-Function Analysis of a Quinone-Dependent Dehydrogenase Capable of Deoxynivalenol Detoxification.
Resolution1.47 Å
Binding residue
(original residue number in PDB)		Q191 D304 E306
Binding residue
(residue number reindexed from 1)		Q189 D302 E304
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0016491 oxidoreductase activity
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:7wmk, PDBe:7wmk, PDBj:7wmk
PDBsum7wmk
PubMed35613468
UniProtA0A6B8QJ68

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