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MolNFT v2 · #180070 · protein

Native crystal structure of S. cerevisiae Csn12 in complex with Thp3 and Sem1

7EWM · Protein THP3: “Native crystal structure of S. cerevisiae Csn12 in complex with Thp3 and Sem1”. X-ray diffraction at 2.9, 10 pockets (best druggability 0.71). MolNFT v2 #180070 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
7EWM
Type
protein
Length
739 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2.9
Source
Saccharomyces cerevisiae S288C
Molecule
Protein THP3; Cop9 signalosome complex subunit 12; 26S proteasome complex subunit SEM1
UniProt
Q12049, P47130, O94742
Pockets
10 · best druggability 0.71

Structure

x-ray diffraction · resolution 2.9 · 3 distinct chains · 61% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProtein THP3protein27262% helix, 6% strandQ12049
BCop9 signalosome complex subunit 12protein40964% helix, 4% strandP47130
C26S proteasome complex subunit SEM1protein5833% helix, 5% strandO94742

Pockets

10 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17760.710.7768empty
24540.660.7846empty
32320.640.8225empty
41840.600.8229empty
53440.570.7637empty

Interfaces

2 interfaces between chains.

  • B–C · 2678 Ų buried · 32 hydrogen bonds · protein-protein
  • A–B · 1244 Ų buried · 13 hydrogen bonds · protein-protein

Compared structures

  • Q12049 · AlphaFold monomer V2.0 prediction for protein THP3 (Q12049) · a predicted model of the same protein · chain A against A, TM-score 0.96
  • P47130 · AlphaFold monomer V2.0 prediction for COP9 signalosome complex subunit 12 (P47130) · a predicted model of the same protein · chain B against A, TM-score 0.95
  • O94742 · AlphaFold monomer V2.0 prediction for 26S proteasome complex subunit SEM1 (O94742) · a predicted model of the same protein · chain C against A, TM-score 0.47

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