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MolNFT v1 · #108901 · protein

Crystal structure of UCH37-nfrkb inhibited deubiquitylating complex

4WLP · Ubiquitin carboxyl-terminal hydrolase isozyme L5: “Crystal structure of UCH37-nfrkb inhibited deubiquitylating complex”. X-ray diffraction, 6 pockets (best druggability 0.69). MolNFT v1 #108901 on GenesisL1: 3D structure, binding…

PDB
4WLP
Type
protein
Length
410 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ubiquitin carboxyl-terminal hydrolase isozyme L5; Nuclear factor related to…
EC
3.4.19.12
UniProt
Q9Y5K5, Q6P4R8
Pockets
6 · best druggability 0.69

Structure

x-ray diffraction · 2 distinct chains · 59% helix, 11% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AUbiquitin carboxyl-terminal hydrolase isozyme L5 (EC 3.4.19.12)protein29653% helix, 15% strandQ9Y5K5
BNuclear factor related to kappa-B-binding proteinprotein11474% helix, 0% strandQ6P4R8

Pockets

6 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15430.690.7946empty
23080.660.8136empty
31710.500.7726empty
4770.390.7817empty
5890.360.7517empty

Interfaces

1 interface between chains.

  • A–B · 2482 Ų buried · 17 hydrogen bonds · protein-protein

Compared structures

  • Q6P4R8 · AlphaFold monomer V2.0 prediction for nuclear factor related to kappa-B-binding protein… · a predicted model of the same protein · chain B against A, TM-score 0.92
  • Q9Y5K5 · AlphaFold monomer V2.0 prediction for ubiquitin carboxyl-terminal hydrolase isozyme L5… · a predicted model of the same protein · chain A against A, TM-score 0.77

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