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MolNFT v1 · #139193 · protein

Crystal structure of mycobacterium tuberculosis marr family protein RV2887 complex with P-aminosalicylic acid

5X7Z · Uncharacterized hth-type transcriptional regulator RV2887: “Crystal structure of mycobacterium tuberculosis marr family protein RV2887 complex with P-aminosalicylic acid”. X-ray diffraction, 1 ligand (BHA), 1 pocket (best…

PDB
5X7Z
Type
protein
Length
130 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Uncharacterized hth-type transcriptional regulator RV2887
UniProt
P9WME9
Ligands
BHA
Pockets
1 · best druggability 0.45

Structure

x-ray diffraction · 1 distinct chain · 72% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AUncharacterized hth-type transcriptional regulator RV2887protein13072% helix, 5% strandP9WME9

Ligands and binding sites

  • BHA · 2-hydroxy-4-aminobenzoic acid · ligand · chains A

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

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12030.450.7324BHA

Compared structures

  • 5X7Z · Crystal structure of mycobacterium tuberculosis marr family protein RV2887 complex with… · the same entry in another collection · chain A against A, TM-score 1.00
  • P9WME9 · AlphaFold monomer V2.0 prediction for hth-type transcriptional repressor RV2887 (P9WME9) · a predicted model of the same protein · chain A against A, TM-score 0.89

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