Structure of PDB 2jcb Chain B Binding Site BS03

Receptor Information
>2jcb Chain B (length=190) Species: 198094 (Bacillus anthracis str. Ames) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
HHVREEKLRLRKQIIEHMNSLSKERYTTLSEQIVFSLYEQKEWAEAKTIG
ITLSMENEVNTYPIIEKAWKEGKRVVVPKCNKETRTMSFRQISNFDQLET
VYMNLREPIPALTEEVNADEIDLQIVPGVAYTERGERIGYGGGYYDRYLV
HYKGKTLSLAYSFQMVEHIPVEPFDKNVEKIITEKGTMVK
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 chain2jcb Chain B Residue 1191 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB2jcb Structure of 5-Formyltetrahydrofolate Cyclo-Ligase from Bacillus Anthracis (Ba4489).
Resolution1.6 Å
Binding residue
(original residue number in PDB)		D144 D173
Binding residue
(residue number reindexed from 1)		D146 D175
Annotation score1
Enzymatic activity
Enzyme Commision number 6.3.3.2: 5-formyltetrahydrofolate cyclo-ligase.
Gene Ontology
Molecular Function
GO:0005524 ATP binding
GO:0030272 5-formyltetrahydrofolate cyclo-ligase activity
GO:0046872 metal ion binding
Biological Process
GO:0008150 biological_process
GO:0009396 folic acid-containing compound biosynthetic process
GO:0035999 tetrahydrofolate interconversion

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Molecular Function
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Biological Process
External links
PDB RCSB:2jcb, PDBe:2jcb, PDBj:2jcb
PDBsum2jcb
PubMed17329806
UniProtA0A6L8PZ12

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