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Structure of adenylyl cyclase 9 in complex with gs protein alpha subunit and mant-GTP

Analyse Structure of adenylyl cyclase 9 in complex with gs protein alpha subunit and… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7PDE
Type
protein
Length
1,187 residues
Chains
2
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Adenylate cyclase 9; Guanine nucleotide-binding protein G(S) subunit alpha isoforms short
UniProt
E1BM79, P04896
Ligands
GSP, MG
Pockets
20 · best druggability 0.81

Structure

electron microscopy · 2 distinct chains · 55% helix, 12% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAdenylate cyclase 9protein84658% helix, 12% strandE1BM79
BGuanine nucleotide-binding protein G(S) subunit alpha isoforms shortprotein34148% helix, 10% strandP04896

Ligands and binding sites

  • GSP · 5'-guanosine-diphosphate-monothiophosphate · ligand · chains B
  • MG · Magnesium ion · metal · chains B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

20 pockets found on a 1 Å grid, 14 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13310.810.9053empty
21130.790.9724empty
32320.780.9237empty
49080.780.8196empty
59110.770.8089empty

Interfaces

1 interface between chains.

  • A–B · 1005 Ų buried · 12 hydrogen bonds · protein-protein

Compared structures

  • 7PDE · Structure of Adenylyl cyclase 9 in complex with Gs protein alpha subunit and MANT-GTP · the same entry in another collection · chain A against A, TM-score 1.00
  • P04896 · AlphaFold monomer V2.0 prediction for guanine nucleotide-binding protein G(S) subunit… · a predicted model of the same protein · chain B against A, TM-score 0.98

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