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Alternate crystal form of human malate dehydrogenase I

Analyse Alternate crystal form of human malate dehydrogenase I in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7RRL
Type
protein
Length
655 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Malate dehydrogenase, cytoplasmic
EC
1.1.1.37, 1.1.1.96
UniProt
P40925
Pockets
7 · best druggability 0.67

Structure

x-ray diffraction · 2 distinct chains · 45% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMalate dehydrogenase, cytoplasmic (EC 1.1.1.37, 1.1.1.96)protein32745% helix, 19% strandP40925
BMalate dehydrogenase, cytoplasmic (EC 1.1.1.37, 1.1.1.96)protein32845% helix, 20% strandP40925

Pockets

7 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1510.670.9616empty
25290.660.7754empty
33750.580.7653empty
43900.570.7463empty
51390.520.8017empty

Interfaces

1 interface between chains.

  • A–B · 1803 Ų buried · 32 hydrogen bonds · protein-protein

Compared structures

  • 7RRL · Alternate Crystal Form of Human Malate Dehydrogenase I · the same entry in another collection · chain A against A, TM-score 1.00
  • P40925 · AlphaFold monomer V2.0 prediction for malate dehydrogenase, cytoplasmic (P40925) · a predicted model of the same protein · chain A against A, TM-score 1.00

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