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MolNFT v1 · #125914 · protein

Structure of spx domain of the yeast inorganic polyphophate polymerase VTC4 crystallized by carrier-driven crystallization in fusion with the macro domain of human histone MACROH2A1.1

5LNC · Vacuolar transporter chaperone 4,CORE histone macro-H2A.1: “Structure of spx domain of the yeast inorganic polyphophate polymerase VTC4 crystallized by carrier-driven…”. X-ray diffraction, 12 pockets (best druggability 0.78). MolNFT…

PDB
5LNC
Type
protein
Length
731 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Vacuolar transporter chaperone 4,CORE histone macro-H2A.1
UniProt
P47075, O75367
Pockets
12 · best druggability 0.78

Structure

x-ray diffraction · 2 distinct chains · 59% helix, 10% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AVacuolar transporter chaperone 4,CORE histone macro-H2A.1protein36459% helix, 10% strandP47075, O75367
BVacuolar transporter chaperone 4,CORE histone macro-H2A.1protein36759% helix, 10% strandP47075, O75367

Pockets

12 pockets found on a 1 Å grid, 8 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16160.780.8389empty
23080.700.8454empty
32830.660.8236empty
43260.630.7947empty
52400.630.8154empty

Interfaces

1 interface between chains.

  • A–B · 1218 Ų buried · 5 hydrogen bonds · protein-protein

Compared structures

  • 5LNC · Structure of SPX domain of the yeast inorganic polyphophate polymerase Vtc4 crystallized… · the same entry in another collection · chain A against A, TM-score 1.00
  • O75367 · AlphaFold monomer V2.0 prediction for core histone macro-H2A.1 (O75367) · a predicted model of the same protein · chain B against A, TM-score 0.52
  • P47075 · AlphaFold monomer V2.0 prediction for vacuolar transporter chaperone 4 (P47075) · a predicted model of the same protein · chain A against A, TM-score 0.49

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