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Crystal structure of methanobacterium thermoautotrophicum nicotinamide mononucleotide adenylyltransferase mutant R11A complexed with NAD

Analyse Crystal structure of methanobacterium thermoautotrophicum nicotinamide… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1M8F
Type
protein
Length
167 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Nicotinamide-nucleotide adenylyltransferase
EC
2.7.7.1
UniProt
O26253
Ligands
NAD
Pockets
1 · best druggability 0.64

Structure

x-ray diffraction · 1 distinct chain · 46% helix, 14% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ANicotinamide-nucleotide adenylyltransferase (EC 2.7.7.1)protein16746% helix, 14% strandO26253

Ligands and binding sites

  • NAD · Nicotinamide-adenine-dinucleotide · ligand · 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
13970.640.7938NAD

Compared structures

  • 1M8F · Crystal Structure Of Methanobacterium Thermoautotrophicum Nicotinamide Mononucleotide… · the same entry in another collection · chain A against A, TM-score 1.00
  • O26253 · AlphaFold monomer V2.0 prediction for nicotinamide-nucleotide adenylyltransferase (O26253) · a predicted model of the same protein · chain A against A, TM-score 0.97

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