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MolNFT v1 · #72451 · protein

Crystal structure of a structural genomics, unknown function (BACOVA_03430) from bacteroides ovatus at 2.40 a resolution

3N91 · Uncharacterized protein: “Crystal structure of a structural genomics, unknown function (BACOVA_03430) from bacteroides ovatus at 2.40 a…”. X-ray diffraction, 1 ligand (CA), 3 pockets (best druggability 0.35). MolNFT v1 #72451 on…

PDB
3N91
Type
protein
Length
315 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Uncharacterized protein
UniProt
A7M003
Ligands
CA
Pockets
3 · best druggability 0.35

Structure

x-ray diffraction · 1 distinct chain · 9% helix, 53% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AUncharacterized proteinprotein3159% helix, 53% strandA7M003

Ligands and binding sites

  • CA · Calcium ion · metal · chains A
  • 2PE · Nonaethylene glycol · additive · 3 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11020.350.7422empty
2660.310.7520empty
3550.270.7418empty

Modifications

Observed in the structure: 5 modified (engineered).

Compared structures

  • 3N91 · Crystal structure of a STRUCTURAL GENOMICS, UNKNOWN FUNCTION (BACOVA_03430) from… · the same entry in another collection · chain A against A, TM-score 1.00

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