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Crystal structure of minor L-lactate dehydrogenase from enterococcus mundtii in the ligands-unbound form

Analyse Crystal structure of minor L-lactate dehydrogenase from enterococcus mundtii in… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3WSV
Type
protein
Length
1,258 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
L-lactate dehydrogenase
EC
1.1.1.27
Pockets
20 · best druggability 0.84

Structure

x-ray diffraction · 2 distinct chains · 41% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, CL-lactate dehydrogenase (EC 1.1.1.27)protein31241% helix, 19% strand—
B, DL-lactate dehydrogenase (EC 1.1.1.27)protein31741% helix, 19% strand—

Ligands and binding sites

  • GOL · Glycerol · additive · 8 copies · chains A, D, B, C

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

Pockets

20 pockets found on a 1 Å grid, 8 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17500.840.8766GOL
27530.840.8765GOL
36050.760.8257empty
47020.740.8052empty
52750.730.8742empty

Interfaces

6 interfaces between chains.

  • C–D · 1628 Ų buried · 13 hydrogen bonds · protein-protein
  • A–B · 1605 Ų buried · 12 hydrogen bonds · protein-protein
  • B–C · 1179 Ų buried · 26 hydrogen bonds · protein-protein
  • A–D · 1151 Ų buried · 18 hydrogen bonds · protein-protein
  • A–C · 1079 Ų buried · 15 hydrogen bonds · protein-protein

Compared structures

  • 3WSV · Crystal structure of minor L-lactate dehydrogenase from Enterococcus mundtii in the… · the same entry in another collection · chain A against A, TM-score 1.00

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