Structure of PDB 7a7e Chain A Binding Site BS01

Receptor Information
>7a7e Chain A (length=172) Species: 208964 (Pseudomonas aeruginosa PAO1) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
HHDSLTSLPNRAFFEGRLSRALRDANEHREQLAVLFIDSDRFKEINDRLG
HAAGDTVLVNIAMRIRGQLRESDLVARLGGDEFAVLLAPLASGADALRIA
DNIIASMQAPIRLSDGSTVSTSLTIGIALYPEHADTPAALLHDADMAMYI
AKRQARGSRRLAELNDPRILQE
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 chain7a7e Chain A Residue 501 [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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PDB7a7e Studying GGDEF Domain in the Act: Minimize Conformational Frustration to Prevent Artefacts.
Resolution2.8 Å
Binding residue
(original residue number in PDB)		D287 S288 D330
Binding residue
(residue number reindexed from 1)		D38 S39 D81
Annotation score1
Enzymatic activity
Enzyme Commision number 2.7.7.65: diguanylate cyclase.
External links
PDB RCSB:7a7e, PDBe:7a7e, PDBj:7a7e
PDBsum7a7e
PubMed33418960
UniProtQ9I4L5|TPBB_PSEAE Diguanylate cyclase TpbB (Gene Name=tpbB)

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