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MolNFT v1 · #118627 · protein

TRIM5 B-BOX2 and coiled-coil chimera

5F7T · Tripartite motif-containing protein 5,SERINE--tRNA ligase…: “TRIM5 B-BOX2 and coiled-coil chimera”. X-ray diffraction, 1 ligand (ZN), 3 pockets (best druggability 0.63). MolNFT v1 #118627 on GenesisL1: 3D structure, binding sites…

PDB
5F7T
Type
protein
Length
532 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Tripartite motif-containing protein 5,SERINE--tRNA ligase, tripartite motif-containing…
EC
6.3.2.-, 6.1.1.11
UniProt
Q0PF16, P34945
Ligands
ZN
Pockets
3 · best druggability 0.63

Structure

x-ray diffraction · 3 distinct chains · 71% helix, 8% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ETripartite motif-containing protein 5,SERINE--tRNA ligase, tripartite motif-containing protein 5 (EC 6.3.2.-, 6.1.1.11)protein13472% helix, 8% strandQ0PF16, P34945
FTripartite motif-containing protein 5,SERINE--tRNA ligase, tripartite motif-containing protein 5 (EC 6.3.2.-, 6.1.1.11)protein13271% helix, 8% strandQ0PF16, P34945
H, LTripartite motif-containing protein 5,SERINE--tRNA ligase, tripartite motif-containing protein 5 (EC 6.3.2.-, 6.1.1.11)protein13371% helix, 8% strandQ0PF16, P34945

Ligands and binding sites

  • ZN · Zinc ion · metal · 8 copies · chains E, F, H, L

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15080.630.7528empty
21480.430.7522empty
31240.410.7521empty

Interfaces

4 interfaces between chains.

  • E–F · 756 Ų buried · 10 hydrogen bonds · protein-protein
  • F–L · 492 Ų buried · 7 hydrogen bonds · protein-protein
  • E–H · 476 Ų buried · 6 hydrogen bonds · protein-protein
  • H–L · 302 Ų buried · 12 hydrogen bonds · protein-protein

Compared structures

  • 5F7T · TRIM5 B-box2 and coiled-coil chimera · the same entry in another collection · chain E against E, TM-score 1.00
  • P34945 · AlphaFold monomer V2.0 prediction for serine--tRNA ligase (P34945) · a predicted model of the same protein · chain H against A, TM-score 0.53
  • Q0PF16 · AlphaFold monomer V2.0 prediction for tripartite motif-containing protein 5 (Q0PF16) · a predicted model of the same protein · chain H against A, TM-score 0.41

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