Structure of PDB 8pps Chain B Binding Site BS01

Receptor Information
>8pps Chain B (length=252) Species: 208964 (Pseudomonas aeruginosa PAO1) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GSHMTWVQRIHLALEEDRFSLYAQPIVPLGEGAEEGLHVELLLRLRDEGG
RLVPPLSFIPAAERYGLMTLIDRWVVENAFRTLVERAQDPRAEPIGTCAI
NLSGATIGDESFLQFLTELFARYRIPPQTICFEVTETVAVANLASAIRFI
NELKDTGCRFSLDDFCAGMSSFIYLKHLPVDYLKIDGSFVKDMLEDPIDR
AMVQVINHIGHVMGKRTIAEFVETVEVMEALREIGIDYAQGLAIGAPLPF
SR
Ligand information
Ligand IDMG
InChIInChI=1S/Mg/q+2
InChIKeyJLVVSXFLKOJNIY-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Mg+2]
CACTVS 3.341[Mg++]
FormulaMg
NameMAGNESIUM ION
ChEMBL
DrugBankDB01378
ZINC
PDB chain8pps Chain B Residue 805 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB8pps Phosphodiesterase activation in the biofilm dispersal protein RbdA and relationship to the biofilm formation protein PA2072 of similar architecture
Resolution2.3 Å
Binding residue
(original residue number in PDB)
E585 N646 E678 D708
Binding residue
(residue number reindexed from 1)
E40 N101 E133 D163
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links