Structure of PDB 4jwp Chain A Binding Site BS02

Receptor Information
>4jwp Chain A (length=165) Species: 359391 (Brucella abortus 2308) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SMTLLIRHATEADLPALLAIYNDAVENTLAIWNETLVDLENRHQWLENRN
RDGFPVLVAEREGQVVGYASYGPFRPFEGFRHSSELSVYVASNARGGGIG
RTLLAELIEEARERKVHVLIAGIEAGNAASIALHRSQGFEECGTLKQVGQ
KFGRWLDLLFMQKIL
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 chain4jwp Chain A Residue 203 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB4jwp Crystal structure of Ribosomal-protein-alanine N-acetyltransferase from Brucella melitensis in complex with Acetyl CoA
Resolution2.0 Å
Binding residue
(original residue number in PDB)		E109 E112
Binding residue
(residue number reindexed from 1)		E110 E113
Annotation score4
Enzymatic activity
Enzyme Commision number 2.3.1.-
Gene Ontology
Molecular Function
GO:0016746 acyltransferase activity
GO:0016747 acyltransferase activity, transferring groups other than amino-acyl groups
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:4jwp, PDBe:4jwp, PDBj:4jwp
PDBsum4jwp
PubMed
UniProtQ2YRK4

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