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MolNFT v1 · #178769 · protein

Crystal structure of TRIM65 pspry domain

7JL4 · Tripartite motif-containing protein 65: “Crystal structure of TRIM65 pspry domain”. X-ray diffraction, 3 pockets (best druggability 0.61). MolNFT v1 #178769 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7JL4
Type
protein
Length
553 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Tripartite motif-containing protein 65
UniProt
Q6PJ69
Pockets
3 · best druggability 0.61

Structure

x-ray diffraction · 3 distinct chains · 6% helix, 42% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATripartite motif-containing protein 65protein1905% helix, 41% strandQ6PJ69
CTripartite motif-containing protein 65protein1767% helix, 45% strandQ6PJ69
BTripartite motif-containing protein 65protein1875% helix, 42% strandQ6PJ69

Ligands and binding sites

  • GOL · Glycerol · additive · 4 copies · chains A, C

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
14710.610.7652empty
2700.450.8214empty
3510.240.7212empty

Interfaces

3 interfaces between chains.

  • A–B · 322 Ų buried · 2 hydrogen bonds · protein-protein
  • A–C · 90 Ų buried · 0 hydrogen bonds · protein-protein
  • C–B · 30 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 7JL4 · Crystal structure of TRIM65 PSpry domain · the same entry in another collection · chain A against A, TM-score 1.00
  • Q6PJ69 · AlphaFold monomer V2.0 prediction for tripartite motif-containing protein 65 (Q6PJ69) · a predicted model of the same protein · chain B against A, TM-score 0.98

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