Structure of PDB 1f4m Chain E Binding Site BS01

Receptor Information
>1f4m Chain E (length=53) Species: 562 (Escherichia coli) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
EKTILNMARFIRSQALTILEKANELDADEIADIAESIHDHADEIYRSALA
RFG
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 chain1f4m Chain E Residue 105 [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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PDB1f4m Dramatic structural and thermodynamic consequences of repacking a protein's hydrophobic core.
Resolution2.25 Å
Binding residue
(original residue number in PDB)		E39 D43
Binding residue
(residue number reindexed from 1)		E35 D39
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0042802 identical protein binding

View graph for
Molecular Function
External links
PDB RCSB:1f4m, PDBe:1f4m, PDBj:1f4m
PDBsum1f4m
PubMed11188696
UniProtP03051|ROP_ECOLX Regulatory protein rop (Gene Name=rop)

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