Structure of PDB 4dbh Chain A Binding Site BS01

Receptor Information
>4dbh Chain A (length=269) Species: 1718 (Corynebacterium glutamicum) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
HMRFGRIATPDGMCFCSIEGEGDDVANLTAREIEGTPFTEPKFTGREWPL
KDVRLLAPMLPSKVVAIGRNYADHVAEVFKKSAESLPPTLFLKPPTAVTG
PESPIRIPSFATKVEFEGELAVVIGKPCKNVKADDWKSVVLGFTIINDVS
SRDLQFADGQWARAKGIDTFGPIGPWIETDINSIDLDNLPIKARLTHDGE
TQLKQDSNSNQMIMKMGEIIEFITASMTLLPGDVIATGSPAGTEAMVDGD
YIEIEIPGIGKLGNPVVDA
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 chain4dbh Chain A 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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PDB4dbh Crystal structures of Cg1458 reveal a catalytic lid domain and a common catalytic mechanism for FAH family.
Resolution1.94 Å
Binding residue
(original residue number in PDB)		E116 E118 D147
Binding residue
(residue number reindexed from 1)		E117 E119 D148
Annotation score4
Enzymatic activity
Enzyme Commision number 4.1.1.-
5.3.3.-
Gene Ontology
Molecular Function
GO:0003824 catalytic activity
GO:0016829 lyase activity
GO:0016853 isomerase activity
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:4dbh, PDBe:4dbh, PDBj:4dbh
PDBsum4dbh
PubMed23046410
UniProtQ8NQY2

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