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MolNFT v1 · #94744 · protein

Crystal structure of yeast AP4A phosphorylase APA2

4I5T · 5',5'''-P-1,P-4-tetraphosphate phosphorylase 2: “Crystal structure of yeast AP4A phosphorylase APA2”. X-ray diffraction, 4 pockets (best druggability 0.69). MolNFT v1 #94744 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
4I5T
Type
protein
Length
611 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
5',5'''-P-1,P-4-tetraphosphate phosphorylase 2
EC
2.7.7.53
UniProt
P22108
Pockets
4 · best druggability 0.69

Structure

x-ray diffraction · 2 distinct chains · 28% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A5',5'''-P-1,P-4-tetraphosphate phosphorylase 2 (EC 2.7.7.53)protein30629% helix, 22% strandP22108
B5',5'''-P-1,P-4-tetraphosphate phosphorylase 2 (EC 2.7.7.53)protein30528% helix, 21% strandP22108

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15900.690.7864empty
25890.690.7865empty
34510.660.7847empty
4500.290.7617empty

Interfaces

1 interface between chains.

  • A–B · 618 Ų buried · 7 hydrogen bonds · protein-protein

Compared structures

  • 4I5T · Crystal structure of yeast Ap4A phosphorylase Apa2 · the same entry in another collection · chain A against A, TM-score 1.00
  • P22108 · AlphaFold monomer V2.0 prediction for diadenosine 5',5'''-P1,P4-tetraphosphate… · a predicted model of the same protein · chain B against A, TM-score 0.97

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