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Human solac complexed with ampcpp

Analyse Human solac complexed with ampcpp in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4OYX
Type
protein
Length
468 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Adenylate cyclase type 10
EC
4.6.1.1
UniProt
Q96PN6
Ligands
ACE, APC, CA, CL
Pockets
5 · best druggability 0.78

Structure

x-ray diffraction · 1 distinct chain · 37% helix, 29% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAdenylate cyclase type 10 (EC 4.6.1.1)protein46837% helix, 29% strandQ96PN6

Ligands and binding sites

  • ACE · Acetyl group · ligand · chains A
  • APC · Diphosphomethylphosphonic acid adenosyl ester · ligand · chains A
  • CA · Calcium ion · metal · chains A
  • CL · Chloride ion · ion · chains A

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

Pockets

5 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14360.780.8649APC, CL
22410.740.8832empty
31570.650.8626empty
42090.490.7630empty
5890.400.7718empty

Modifications

Observed in the structure: 1 covalent, 1 modified (covalent ligand, artifact).

Compared structures

  • 4OYX · Human solAC Complexed with AMPCPP · 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 0.95

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