Structure of PDB 3g82 Chain A Binding Site BS01

Receptor Information

>3g82 Chain A (length=189) Species: 9615 (Canis lupus familiaris)

MMFHKIYIQKHDNVSILFADIEGFTSLASQCTAQELVMTLNELFARFDKL
AAENHCLRIKILGDCYYCVSGLPEARADHAHCCVEMGMDMIEAISLVREM
TGVNVNMRVGIHSGRVHCGVLGLRKWQFDVWSNDVTLANHMEAGGKAGRI
HITKATLSYLNGDYEVEPGCGGERNAYLKEHSIETFLIL

Ligand information

• Ligand ID: MN
• InChI: InChI=1S/Mn/q+2
• InChIKey: WAEMQWOKJMHJLA-UHFFFAOYSA-N
• SMILES:
  ACDLabs 10.04
  OpenEye OEToolkits 1.5.0: [Mn+2]
  CACTVS 3.341: [Mn++]
• Formula: Mn
• Name: MANGANESE (II) ION
• DrugBank: DB06757
• PDB chain: 3g82 Chain A Residue 581

Receptor-Ligand Complex Structure

Structure summary

• PDB: 3g82 2',3'-(O)-(N-Methyl)anthraniloyl-inosine 5'-triphosphate is the Most Potent Adenylyl Cyclase 1 and 5 Inhibitor Known so far and Effectively Promotes Catalytic Subunit Assembly in the Absence of Forskolin
• Resolution: 3.11 Å
• Binding residue (original residue number in PDB): D396 D440
• Binding residue (residue number reindexed from 1): D20 D64
• Annotation score: 1

Enzymatic activity

• Catalytic site (original residue number in PDB): D396 I397 D440 H516
• Catalytic site (residue number reindexed from 1): D20 I21 D64 H140
• Enzyme Commision number: 4.6.1.1: adenylate cyclase.

Gene Ontology

Molecular Function

• GO:0016849 phosphorus-oxygen lyase activity

Biological Process

• GO:0009190 cyclic nucleotide biosynthetic process
• GO:0035556 intracellular signal transduction

External links

• PDB: RCSB:3g82, PDBe:3g82, PDBj:3g82
• PDBsum: 3g82
• UniProt: P30803|ADCY5_CANLF Adenylate cyclase type 5 (Gene Name=ADCY5)