GL1X · GenesisL1 explorer

MolNFT v1 · #184597 · protein

Human soluble adenylyl cyclase in complex with the inhibitor TDI10229

7OVD: “Human soluble adenylyl cyclase in complex with the inhibitor TDI10229”. X-ray diffraction, 1 ligand (1S2). MolNFT v1 #184597 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7OVD
Type
protein
Length
449 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q96PN6
Ligands
1S2

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein449—Q96PN6

Ligands and binding sites

  • 1S2 · 4-chloranyl-6-[1,5-dimethyl-4-(phenylmethyl)pyrazol-3-yl]pyrimidin-2-amine · ligand · chains A
  • EDO · 1,2-ethanediol · additive · 6 copies · chains A
  • ACT · Acetate ion · additive · 4 copies · chains A
  • DMS · Dimethyl sulfoxide · additive · 4 copies · chains A

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

Compared structures

  • 7OVD · Human soluble adenylyl cyclase in complex with the inhibitor TDI10229 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q96PN6 · AlphaFold monomer V2.0 prediction for adenylate cyclase type 10 (Q96PN6) · a predicted model of the same protein · chain A against A, TM-score 0.96

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