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Crystal structure of cobt complexed with imidazole

Analyse Crystal structure of cobt complexed with imidazole in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1L5N
Type
protein
Length
346 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Nicotinate-nucleotide--dimethylbenzimidazole phosphoribosyltransferase
EC
2.4.2.21
UniProt
Q05603
Ligands
PO4
Pockets
1 · best druggability 0.68

Structure

x-ray diffraction · 1 distinct chain · 52% helix, 11% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ANicotinate-nucleotide--dimethylbenzimidazole phosphoribosyltransferase (EC 2.4.2.21)protein34652% helix, 11% strandQ05603

Ligands and binding sites

  • PO4 · Phosphate ion · ion · chains A
  • IMD · Imidazole · additive · 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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11780.680.8734PO4, IMD

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 1L5N · Crystal Structure of CobT complexed with imidazole · the same entry in another collection · chain A against A, TM-score 1.00
  • Q05603 · AlphaFold monomer V2.0 prediction for nicotinate-nucleotide-- dimethylbenzimidazole… · a predicted model of the same protein · chain A against A, TM-score 1.00

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