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MolNFT v1 · #144329 · protein

2.55 ångström resolution crystal structure of N-terminal fragment (residues 1-493) of DNA topoisomerase IV subunit a from pseudomonas putida

6BQ9 · DNA topoisomerase 4 subunit a: “2.55 ångström resolution crystal structure of N-terminal fragment (residues 1-493) of DNA topoisomerase IV…”. X-ray diffraction, 2 ligands (NA, CL), 6 pockets (best druggability 0.64). MolNFT v1…

PDB
6BQ9
Type
protein
Length
457 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA topoisomerase 4 subunit a
EC
5.99.1.3
UniProt
Q88DB5
Ligands
NA, CL
Pockets
6 · best druggability 0.64

Structure

x-ray diffraction · 1 distinct chain · 46% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADNA topoisomerase 4 subunit a (EC 5.99.1.3)protein45746% helix, 16% strandQ88DB5

Ligands and binding sites

  • NA · Sodium ion · metal · chains A
  • CL · Chloride ion · ion · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13140.640.8046NA
21870.520.7836CL
3570.450.8314empty
4890.360.7512empty
5540.350.7914empty

Compared structures

  • 6BQ9 · 2.55 Angstrom Resolution Crystal Structure of N-terminal Fragment (residues 1-493) of DNA… · the same entry in another collection · chain A against A, TM-score 1.00

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