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MolNFT v1 · #25288 · protein

Crystal structure of a putative methyltransferase (BH2331) from bacillus halodurans C-125 at 1.95 a resolution

1VL5 · Unknown conserved protein BH2331: “Crystal structure of a putative methyltransferase (BH2331) from bacillus halodurans C-125 at 1.95 a resolution”. X-ray diffraction, 10 pockets (best druggability 0.64). MolNFT v1 #25288 on…

PDB
1VL5
Type
protein
Length
906 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Unknown conserved protein BH2331
UniProt
Q9KAF6
Pockets
10 · best druggability 0.64

Structure

x-ray diffraction · 2 distinct chains · 39% helix, 31% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, DUnknown conserved protein BH2331protein23141% helix, 30% strandQ9KAF6
CUnknown conserved protein BH2331protein21338% helix, 32% strandQ9KAF6

Pockets

10 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11230.640.8824empty
21130.590.8525empty
32880.540.7644empty
42950.540.7544empty
52400.520.7635empty

Interfaces

2 interfaces between chains.

  • A–B · 916 Ų buried · 7 hydrogen bonds · protein-protein
  • A–C · 864 Ų buried · 17 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 20 modified (engineered).

Compared structures

  • 1VL5 · Crystal structure of a putative methyltransferase (BH2331) from bacillus halodurans C-125… · the same entry in another collection · chain A against A, TM-score 1.00

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