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Crystal structure of the N-terminal domain of the yeast general corepressor TUP1P

Analyse Crystal structure of the N-terminal domain of the yeast general corepressor… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3VP8
Type
protein
Length
310 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
General transcriptional corepressor TUP1
UniProt
P16649
Pockets
5 · best druggability 0.85

Structure

x-ray diffraction · 4 distinct chains · 96% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGeneral transcriptional corepressor TUP1protein7596% helix, 0% strandP16649
BGeneral transcriptional corepressor TUP1protein8096% helix, 0% strandP16649
CGeneral transcriptional corepressor TUP1protein7796% helix, 0% strandP16649
DGeneral transcriptional corepressor TUP1protein7895% helix, 0% strandP16649

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15520.850.9163empty
2930.580.8620empty
3690.580.8917empty
4780.360.7610empty
5530.280.7411empty

Interfaces

6 interfaces between chains.

  • C–D · 1704 Ų buried · 23 hydrogen bonds · protein-protein
  • A–B · 1695 Ų buried · 12 hydrogen bonds · protein-protein
  • A–C · 1103 Ų buried · 12 hydrogen bonds · protein-protein
  • B–D · 1090 Ų buried · 10 hydrogen bonds · protein-protein
  • B–C · 774 Ų buried · 8 hydrogen bonds · protein-protein

Compared structures

  • 3VP8 · Crystal structure of the N-terminal domain of the yeast general corepressor Tup1p · the same entry in another collection · chain D against D, TM-score 1.00
  • P16649 · AlphaFold monomer V2.0 prediction for general transcriptional corepressor TUP1 (P16649) · a predicted model of the same protein · chain C against A, TM-score 0.93

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