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MolNFT v1 · #103282 · protein

Structure of the human RBAP48-MTA1(670-711) complex

4PC0 · Histone-binding protein RBBP4: “Structure of the human RBAP48-MTA1(670-711) complex”. X-ray diffraction, 1 ligand (CA), 11 pockets (best druggability 0.79). MolNFT v1 #103282 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
4PC0
Type
protein
Length
846 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Histone-binding protein RBBP4; Metastasis-associated protein MTA1
UniProt
Q09028, Q13330
Ligands
CA
Pockets
11 · best druggability 0.79

Structure

x-ray diffraction · 3 distinct chains · 10% helix, 42% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHistone-binding protein RBBP4protein4029% helix, 43% strandQ09028
BHistone-binding protein RBBP4protein4049% helix, 42% strandQ09028
C, DMetastasis-associated protein MTA1protein2040% helix, 0% strandQ13330

Ligands and binding sites

  • CA · Calcium ion · metal · 2 copies · chains A, B
  • GOL · Glycerol · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110380.790.8171empty
24330.750.8430empty
34570.750.8331empty
43030.560.7642empty
52670.530.7537empty

Interfaces

3 interfaces between chains.

  • A–C · 953 Ų buried · 18 hydrogen bonds · protein-protein
  • B–D · 926 Ų buried · 16 hydrogen bonds · protein-protein
  • A–B · 452 Ų buried · 5 hydrogen bonds · protein-protein

Compared structures

  • 4PC0 · Structure of the human RbAp48-MTA1(670-711) complex · the same entry in another collection · chain A against A, TM-score 1.00
  • Q09028 · AlphaFold monomer V2.0 prediction for histone-binding protein RBBP4 (Q09028) · a predicted model of the same protein · chain A against A, TM-score 0.97
  • Q13330 · AlphaFold monomer V2.0 prediction for metastasis-associated protein MTA1 (Q13330) · a predicted model of the same protein · chain C against A, TM-score 0.55

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