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MolNFT v1 · #102594 · protein

Mycobacterium tuberculosis reca glycerol bound low temperature structure iib-sr

4OQF · Protein reca: “Mycobacterium tuberculosis reca glycerol bound low temperature structure iib-sr”. X-ray diffraction, 4 pockets (best druggability 0.47). MolNFT v1 #102594 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4OQF
Type
protein
Length
310 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protein reca
EC
3.1.-.-
UniProt
P0A5U4
Pockets
4 · best druggability 0.47

Structure

x-ray diffraction · 1 distinct chain · 41% helix, 22% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProtein reca (EC 3.1.-.-)protein31041% helix, 22% strandP0A5U4

Ligands and binding sites

  • EDO · 1,2-ethanediol · additive · 2 copies · chains A
  • GOL · Glycerol · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11640.470.7629GOL
21450.440.7631EDO
31140.370.7429empty
4690.340.7615empty

Compared structures

  • 4OQF · Mycobacterium tuberculosis RecA glycerol bound low temperature structure IIB-SR · the same entry in another collection · chain A against A, TM-score 1.00

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