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MolNFT v1 · #129362 · protein

Crystal structure of mycolicibacterium hassiacum glucosylglycerate hydrolase (mhggh) in complex with serine and glycerol

5OI0 · Uncharacterized protein: “Crystal structure of mycolicibacterium hassiacum glucosylglycerate hydrolase (mhggh) in complex with serine…”. X-ray diffraction, 1 ligand (SER), 3 pockets (best druggability 0.84). MolNFT v1 #129362 on…

PDB
5OI0
Type
protein
Length
890 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Uncharacterized protein
UniProt
K5BDL0
Ligands
SER
Pockets
3 · best druggability 0.84

Structure

x-ray diffraction · 1 distinct chain · 51% helix, 6% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BUncharacterized proteinprotein44551% helix, 6% strandK5BDL0

Ligands and binding sites

  • SER · Serine · ligand · 2 copies · chains A, B
  • GOL · Glycerol · additive · 13 copies · chains A, B

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

Pockets

3 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19660.840.8590empty
2720.760.9921GOL, SER
3640.730.9819GOL, SER

Interfaces

1 interface between chains.

  • A–B · 613 Ų buried · 8 hydrogen bonds · protein-protein

Compared structures

  • 5OI0 · Crystal structure of Mycolicibacterium hassiacum glucosylglycerate hydrolase (MhGgH) in… · the same entry in another collection · chain A against A, TM-score 1.00
  • K5BDL0 · AlphaFold monomer V2.0 prediction for glucosylglycerate hydrolase (K5BDL0) · a predicted model of the same protein · chain A against A, TM-score 1.00

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