Structure of PDB 4m6v Chain C Binding Site BS01

Receptor Information
>4m6v Chain C (length=596) Species: 347834 (Rhizobium etli CFN 42) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
DRATKLLTYLADVTVNGHPEAKDRPKPLENAARPVVPYAGNGVKDGTKQL
LDTLGPKKFGEWMRNEKRVLLTDTTMRDGHQSLLATRMRTYDIARIAGTY
SHALPNLLSLECWGGATFDVSMRFLTEDPWERLALIREGAPNLLLQMLLR
GANGVGYTNYPDNVVKYFVRQAAKGGIDLFRVFDCLNWVENMRVSMDAIA
EENKLCEAAICYTGDILNSARPKYDLKYYTNLAVELEKAGAHIIAVKDMA
GLLKPAAAKVLFKALREATGLPIHFHTHDTSGIAAATVLAAVEAGVDAVD
AAMDALSGNTSQPCLGSIVEALSGSERDPGLDPAWIRRISFYWEAVRNQY
AAFESDLKGPASEVYLHEMPGGQFTNLKEQARSLGLETRWHQVAQAYADA
NQMFGDIVKVTPSSKVVGDMALMMVSQDLTVADVVSPDREVSFPESVVSM
LKGDLGQPPSGWPEALQKKALKGEKPYTVRPGSLLKEADLDAERKVIEKK
LEREVSDFEFASYLMYPKVFTDFALASDTYGPVSVLPTPAYFYGLADGEE
LFADIEKGKTLVIVNQAVSATDSQGMVTVFFELNGQPRRIKVPDRA
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain4m6v Chain C Residue 1101 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB4m6v The role of biotin and oxamate in the carboxyltransferase reaction of pyruvate carboxylase.
Resolution2.4 Å
Binding residue
(original residue number in PDB)
D549 K718 H747 H749
Binding residue
(residue number reindexed from 1)
D78 K247 H276 H278
Annotation score1
Enzymatic activity
Catalytic site (original residue number in PDB) D549 D655 K718 H747 H749 T882
Catalytic site (residue number reindexed from 1) D78 D184 K247 H276 H278 T411
Enzyme Commision number 6.4.1.1: pyruvate carboxylase.
Gene Ontology
Molecular Function
GO:0003824 catalytic activity
GO:0004736 pyruvate carboxylase activity
GO:0005524 ATP binding
Biological Process
GO:0006090 pyruvate metabolic process
GO:0006094 gluconeogenesis

View graph for
Molecular Function

View graph for
Biological Process
External links
PDB RCSB:4m6v, PDBe:4m6v, PDBj:4m6v
PDBsum4m6v
PubMed25157442
UniProtQ2K340

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