Structure of PDB 4bih Chain A Binding Site BS01

Receptor Information
>4bih Chain A (length=172) Species: 93061 (Staphylococcus aureus subsp. aureus NCTC 8325) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
LSMYPIKNLEDLYDKEGYRDDQFDKNDKGTWIINSEMVIQPNNEDMVAKG
MVLYMNRNTKTTNGYYYVDVTKDEKRYPVKMVDNKIIPTKEIKDEKIKKE
IENFKFFVQYGDFSAKYQLTNDDYNVKQLRKRYDIPTSKAPKLLLKKDIE
FTFVEKKEENIYFSDSLDYKKS
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 chain4bih Chain A Residue 1253 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
PDB4bih Mining the Bacterial Unknown Proteome: Identification and Characterization of a Novel Family of Highly Conserved Protective Antigens in Staphylococcus Aureus
Resolution2.459 Å
Binding residue
(original residue number in PDB)		D191 N193
Binding residue
(residue number reindexed from 1)		D123 N125
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:4bih, PDBe:4bih, PDBj:4bih
PDBsum4bih
PubMed23895222
UniProtQ2G1Q1|Y052_STAA8 Uncharacterized lipoprotein SAOUHSC_00052 (Gene Name=SAOUHSC_00052)

[Back to BioLiP]