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MolNFT v1 · #134820 · protein

Structure of the hetero-trimer of RTT102-ARP7/9 bound to ATP

5TGC · Actin-related protein 7: “Structure of the hetero-trimer of RTT102-ARP7/9 bound to ATP”. X-ray diffraction, 2 ligands (ATP, SO4), 15 pockets (best druggability 0.87). MolNFT v1 #134820 on GenesisL1: 3D structure, binding sites and…

PDB
5TGC
Type
protein
Length
1,750 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Actin-related protein 7; Actin-like protein ARP9; Regulator of TY1 transposition protein…
UniProt
Q12406, Q05123, P53330
Ligands
ATP, SO4
Pockets
15 · best druggability 0.87

Structure

x-ray diffraction · 6 distinct chains · 41% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AActin-related protein 7protein40746% helix, 19% strandQ12406
BActin-like protein ARP9protein39540% helix, 19% strandQ05123
CRegulator of TY1 transposition protein 102protein6710% helix, 22% strandP53330
DActin-related protein 7protein42845% helix, 19% strandQ12406
EActin-like protein ARP9protein39141% helix, 20% strandQ05123
FRegulator of TY1 transposition protein 102protein6218% helix, 23% strandP53330

Ligands and binding sites

  • ATP · Adenosine-5'-triphosphate · ligand · 2 copies · chains A, D
  • SO4 · Sulfate ion · ion · 3 copies · chains B, E

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

Pockets

15 pockets found on a 1 Å grid, 9 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16810.870.91108ATP
29510.860.88119ATP
35750.860.9170empty
47280.830.8678empty
54590.710.8134empty

Interfaces

10 interfaces between chains.

  • B–C · 1951 Ų buried · 22 hydrogen bonds · protein-protein
  • E–F · 1630 Ų buried · 21 hydrogen bonds · protein-protein
  • A–B · 1614 Ų buried · 17 hydrogen bonds · protein-protein
  • B–E · 1575 Ų buried · 19 hydrogen bonds · protein-protein
  • D–E · 1474 Ų buried · 20 hydrogen bonds · protein-protein

Compared structures

  • 5TGC · Structure of the hetero-trimer of Rtt102-Arp7/9 bound to ATP · the same entry in another collection · chain F against F, TM-score 1.00
  • Q12406 · AlphaFold monomer V2.0 prediction for actin-related protein 7 (Q12406) · a predicted model of the same protein · chain A against A, TM-score 0.97
  • Q05123 · AlphaFold monomer V2.0 prediction for actin-like protein ARP9 (Q05123) · a predicted model of the same protein · chain E against A, TM-score 0.96
  • P53330 · AlphaFold monomer V2.0 prediction for regulator of TY1 transposition protein 102 (P53330) · a predicted model of the same protein · chain C against A, TM-score 0.47

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