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TRIM5 B-BOX2 and coiled-coil chimera

Analyse TRIM5 B-BOX2 and coiled-coil chimera in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5IEA
Type
protein
Length
708 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Tripartite motif-containing protein 5, serine--tRNA ligase chimera
EC
6.3.2.-, 6.1.1.11
UniProt
Q0PF16, P34945
Ligands
ZN
Pockets
7 · best druggability 0.63

Structure

x-ray diffraction · 1 distinct chain · 66% helix, 9% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, D, F, KTripartite motif-containing protein 5, serine--tRNA ligase chimera (EC 6.3.2.-, 6.1.1.11)protein11866% helix, 9% strandQ0PF16, P34945

Ligands and binding sites

  • ZN · Zinc ion · metal · 12 copies · chains A, B, C, D, F, K

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

Pockets

7 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12720.630.8142empty
21750.600.8223empty
33210.580.7635empty
42880.500.7330empty
51880.440.7324empty

Interfaces

12 interfaces between chains.

  • B–D · 336 Ų buried · 6 hydrogen bonds · protein-protein
  • C–K · 336 Ų buried · 8 hydrogen bonds · protein-protein
  • F–K · 335 Ų buried · 6 hydrogen bonds · protein-protein
  • A–B · 334 Ų buried · 6 hydrogen bonds · protein-protein
  • A–D · 334 Ų buried · 8 hydrogen bonds · protein-protein

Compared structures

  • 5IEA · TRIM5 B-box2 and coiled-coil chimera · the same entry in another collection · chain K against K, TM-score 1.00
  • Q0PF16 · AlphaFold monomer V2.0 prediction for tripartite motif-containing protein 5 (Q0PF16) · a predicted model of the same protein · chain A against A, TM-score 0.59
  • P34945 · AlphaFold monomer V2.0 prediction for serine--tRNA ligase (P34945) · a predicted model of the same protein · chain A against A, TM-score 0.50

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