Structure of PDB 4nhf Chain B Binding Site BS01

Receptor Information
>4nhf Chain B (length=138) Species: 634504 (Bartonella grahamii as4aup) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SYGEVVDRYWLNQYVLNRENYDYDTIQLNYDTTALLSAASVQQEYYKIYD
GENARDKVLSNKARITVKVRSIQLNGLGQATVRFTTQQLDSTTGPKQHQI
ATIGYTYVGAPMKSSDRLLNPLGFQITSYRSDPEILLN
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 chain4nhf Chain B Residue 301 [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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PDB4nhf Structural Insight into How Bacteria Prevent Interference between Multiple Divergent Type IV Secretion Systems.
Resolution2.0 Å
Binding residue
(original residue number in PDB)		D113 D115
Binding residue
(residue number reindexed from 1)		D22 D24
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology

View graph for
Cellular Component
External links
PDB RCSB:4nhf, PDBe:4nhf, PDBj:4nhf
PDBsum4nhf
PubMed26646013
UniProtC6AAT5

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