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MolNFT v1 · #123966 · protein

Cryo-EM structure of lactate dehydrogenase (ldh) in inhibitor-bound state

5K0Z · L-lactate dehydrogenase B chain: “Cryo-EM structure of lactate dehydrogenase (ldh) in inhibitor-bound state”. Electron microscopy, 20 pockets (best druggability 0.83). MolNFT v1 #123966 on GenesisL1: 3D structure, binding sites and…

PDB
5K0Z
Type
protein
Length
1,268 residues
Chains
4
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
L-lactate dehydrogenase B chain
EC
1.1.1.27
UniProt
P00337
Pockets
20 · best druggability 0.83

Structure

electron microscopy · 1 distinct chain · 40% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DL-lactate dehydrogenase B chain (EC 1.1.1.27)protein31740% helix, 21% strandP00337

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13920.830.9248empty
23500.810.9147empty
31100.640.8934empty
41250.560.8325empty
51130.550.8426empty

Interfaces

6 interfaces between chains.

  • C–D · 2819 Ų buried · 22 hydrogen bonds · protein-protein
  • A–B · 2818 Ų buried · 22 hydrogen bonds · protein-protein
  • B–D · 1454 Ų buried · 27 hydrogen bonds · protein-protein
  • A–C · 1445 Ų buried · 27 hydrogen bonds · protein-protein
  • B–C · 967 Ų buried · 14 hydrogen bonds · protein-protein

Compared structures

  • 5K0Z · Cryo-EM structure of lactate dehydrogenase (LDH) in inhibitor-bound state · the same entry in another collection · chain A against A, TM-score 1.00
  • P00337 · AlphaFold monomer V2.0 prediction for L-lactate dehydrogenase B chain (P00337) · a predicted model of the same protein · chain A against A, TM-score 0.99

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