Structure of PDB 3s6j Chain A Binding Site BS01

Receptor Information
>3s6j Chain A (length=216) Species: 323 (Pseudomonas syringae pv. tomato) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PQTSFIFDLDGTLTDSVYQNVAAWKEALDAENIPLAMWRIHRKIGMSGGL
MLKSLSREITDEQAERLSEKHAQAYERLQHQIIALPGAVELLETLDKENL
KWCIATSGGIDTATINLKALKLDINKINIVTRDDVSYGKPDPDLFLAAAK
KIGAPIDECLVIGDAIWDMLAARRCKATGVGLLSGGYDIGELERAGALRV
YEDPLDLLNHLDEIAS
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 chain3s6j Chain A Residue 4 [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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PDB3s6j The crystal structure of a hydrolase from Pseudomonas syringae
Resolution2.198 Å
Binding residue
(original residue number in PDB)		D113 D115 D273
Binding residue
(residue number reindexed from 1)		D8 D10 D164
Annotation score4
Enzymatic activity
Catalytic site (original residue number in PDB) D113 D115 S121 I149 T215 S216 K248 G272 D273
Catalytic site (residue number reindexed from 1) D8 D10 S16 I44 T106 S107 K139 G163 D164
Enzyme Commision number ?
External links