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MolNFT v1 · #86494 · protein

N-terminal domain of the yeast NOT1

4B8B · General negative regulator of transcription subunit 1: “N-terminal domain of the yeast NOT1”. X-ray diffraction, 1 ligand (AU), 11 pockets (best druggability 0.67). MolNFT v1 #86494 on GenesisL1: 3D structure, binding sites and…

PDB
4B8B
Type
protein
Length
1,057 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
General negative regulator of transcription subunit 1
UniProt
P25655
Ligands
AU
Pockets
11 · best druggability 0.67

Structure

x-ray diffraction · 2 distinct chains · 70% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGeneral negative regulator of transcription subunit 1protein52870% helix, 0% strandP25655
BGeneral negative regulator of transcription subunit 1protein52970% helix, 0% strandP25655

Ligands and binding sites

  • AU · Gold ion · metal · 29 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14930.670.7852AU
21420.670.8831empty
31490.660.8732empty
44250.640.7846AU
51600.560.8124AU

Interfaces

1 interface between chains.

  • A–B · 1494 Ų buried · 18 hydrogen bonds · protein-protein

Compared structures

  • 4B8B · N-Terminal domain of the yeast Not1 · the same entry in another collection · chain A against A, TM-score 1.00
  • P25655 · AlphaFold monomer V2.0 prediction for general negative regulator of transcription subunit… · a predicted model of the same protein · chain A against A, TM-score 0.94

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