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MolNFT v1 · #71101 · protein

Crystal structure of the mutant V182A of orotidine 5'-monophosphate decarboxylase from methanobacterium thermoautotrophicum

3M41 · Orotidine 5'-phosphate decarboxylase: “Crystal structure of the mutant V182A of orotidine 5'-monophosphate decarboxylase from methanobacterium…”. X-ray diffraction, 2 pockets (best druggability 0.67). MolNFT v1 #71101 on GenesisL1…

PDB
3M41
Type
protein
Length
415 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Orotidine 5'-phosphate decarboxylase
EC
4.1.1.23
UniProt
O26232
Pockets
2 · best druggability 0.67

Structure

x-ray diffraction · 2 distinct chains · 50% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AOrotidine 5'-phosphate decarboxylase (EC 4.1.1.23)protein20750% helix, 18% strandO26232
BOrotidine 5'-phosphate decarboxylase (EC 4.1.1.23)protein20850% helix, 19% strandO26232

Ligands and binding sites

  • GOL · Glycerol · additive · 5 copies · chains A, B

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

Pockets

2 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12820.670.8333empty
22520.660.8336empty

Interfaces

1 interface between chains.

  • A–B · 1651 Ų buried · 22 hydrogen bonds · protein-protein

Compared structures

  • 3M41 · Crystal structure of the mutant V182A of orotidine 5'-monophosphate decarboxylase from… · the same entry in another collection · chain A against A, TM-score 1.00

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