Structure of PDB 3vti Chain D Binding Site BS01

Receptor Information
>3vti Chain D (length=305) Species: 273068 (Caldanaerobacter subterraneus subsp. tengcongensis MB4) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GALIEEVFADAFDNEYIRAMEDAALLFGNITLTTDSFTVKPLFFPGGDIG
KLAVCGTVNDASMRGAKPLFLTAAFIIEEGFPVEDLKKIVKSMAEAAKEA
GVKIVAGDTKVVEKGSVDRIFINTSGIGVLYEGANVSIKNAKPGDIVLIS
GTIGDHGMAVMSAREELQFDTPIFSDVAPLNGLIEKLMTLGEAIKVLRDP
TRGGVAEVLYEISKMSGVGIKIYEEKLPVKESVKSACEFMGIDFLHLANE
GKVVVVVERDYAEKALEIMKSHEYGKDAEIIGEVNDSKLVTINTIYGTSR
IVDRP
Ligand information
Ligand IDMG
InChIInChI=1S/Mg/q+2
InChIKeyJLVVSXFLKOJNIY-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mg+2]
CACTVS 3.341[Mg++]
FormulaMg
NameMAGNESIUM ION
ChEMBL
DrugBankDB01378
ZINC
PDB chain3vti Chain D Residue 401 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB3vti Structural basis for the reaction mechanism of S-carbamoylation of HypE by HypF in the maturation of [NiFe]-hydrogenases
Resolution2.56 Å
Binding residue
(original residue number in PDB)		D59 D97 D236
Binding residue
(residue number reindexed from 1)		D22 D60 D199
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links