GL1X · GenesisL1 explorer

MolNFT v1 · #84134 · protein

Apaf-1 card in complex with prodomain of procaspase-9

3YGS · Apoptotic protease activating factor 1: “Apaf-1 card in complex with prodomain of procaspase-9”. X-ray diffraction, 1 pocket (best druggability 0.36). MolNFT v1 #84134 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
3YGS
Type
protein
Length
192 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Apoptotic protease activating factor 1; Procaspase 9
EC
3.4.22.-
UniProt
O14727, P55211
Pockets
1 · best druggability 0.36

Structure

x-ray diffraction · 2 distinct chains · 70% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
CApoptotic protease activating factor 1protein9574% helix, 0% strandO14727
PProcaspase 9 (EC 3.4.22.-)protein9766% helix, 0% strandP55211

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1690.360.7816empty

Interfaces

1 interface between chains.

  • C–P · 486 Ų buried · 11 hydrogen bonds · protein-protein

Compared structures

  • 3YGS · Apaf-1 card in complex with prodomain of procaspase-9 · the same entry in another collection · chain C against C, TM-score 1.00
  • P55211 · AlphaFold monomer V2.0 prediction for caspase-9 (P55211) · a predicted model of the same protein · chain P against A, TM-score 0.96
  • O14727 · AlphaFold monomer V2.0 prediction for apoptotic protease-activating factor 1 (O14727) · a predicted model of the same protein · chain C against A, TM-score 0.95

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