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MolNFT v1 · #54190 · protein

Crystal structure of domain 2 of thermotoga maritima N-utilization substance G (nusg)

2XHA · Transcription antitermination protein nusg: “Crystal structure of domain 2 of thermotoga maritima N-utilization substance G (nusg)”. X-ray diffraction, 4 pockets (best druggability 0.81). MolNFT v1 #54190 on GenesisL1: 3D structure…

PDB
2XHA
Type
protein
Length
386 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Transcription antitermination protein nusg
UniProt
P29397
Pockets
4 · best druggability 0.81

Structure

x-ray diffraction · 1 distinct chain · 3% helix, 47% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BTranscription antitermination protein nusgprotein1933% helix, 47% strandP29397

Ligands and binding sites

  • ACT · Acetate ion · additive · 7 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17200.810.8584ACT
23700.770.8753ACT
3800.340.7515empty
4620.290.7414empty

Interfaces

1 interface between chains.

  • A–B · 712 Ų buried · 7 hydrogen bonds · protein-protein

Compared structures

  • 2XHA · Crystal Structure of Domain 2 of Thermotoga maritima N-utilization Substance G (NusG) · the same entry in another collection · chain A against A, TM-score 1.00
  • P29397 · AlphaFold monomer V2.0 prediction for transcription TERMINATION/ANTITERMINATION protein… · a predicted model of the same protein · chain A against A, TM-score 0.94

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