Structure of PDB 8dj2 Chain B Binding Site BS01

Receptor Information
>8dj2 Chain B (length=145) Species: 813 (Chlamydia trachomatis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PKGKLATTVSVGGVKASVGGGVRVTSAQAGAGVDVADTIAYTGLVAGEAY
SVSGSLFEVADGRTVGDAIVTKTEQFTASDSGAGEWTVEFGRVAGLEPGK
QYVVFETATSVKDLVDTDGDDVPDAAQVEKHEDPNDASQTVVVEE
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 chain8dj2 Chain B Residue 1003 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB8dj2 Intramolecular ester bond-containing repeat domain from Chlamydia trachomatis adhesin
Resolution1.5 Å
Binding residue
(original residue number in PDB)		D887 D889 D891 V893 D895
Binding residue
(residue number reindexed from 1)		D116 D118 D120 V122 D124
Annotation score4
External links