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MolNFT v1 · #126467 · protein

Structure of the GH99 endo-alpha-mannanase from bacteroides xylanisolvens in complex with mannose-alpha-1,3-1,2-dideoxymannose and alpha-1,2-mannobiose

5M3W · Glycosyl hydrolase family 71: “Structure of the GH99 endo-alpha-mannanase from bacteroides xylanisolvens in complex with…”. X-ray diffraction, 2 ligands (7D1, MAN), 2 pockets (best druggability 0.49). MolNFT v1 #126467 on GenesisL1…

PDB
5M3W
Type
protein
Length
350 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glycosyl hydrolase family 71
UniProt
D6D1V7
Ligands
7D1, MAN
Pockets
2 · best druggability 0.49

Structure

x-ray diffraction · 1 distinct chain · 35% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGlycosyl hydrolase family 71protein35035% helix, 17% strandD6D1V7

Ligands and binding sites

  • 7D1 · 1,5-anhydro-2-deoxy-D-arabino-hexitol · ligand · chains A
  • MAN · alpha-D-mannopyranose · sugar · 3 copies · chains A
  • ACT · Acetate ion · additive · 2 copies · chains A
  • EDO · 1,2-ethanediol · additive · chains A

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

Pockets

2 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11580.490.77327D1, MAN
2520.340.7817empty

Compared structures

  • 5M3W · Structure of the GH99 endo-alpha-mannanase from Bacteroides xylanisolvens in complex with… · the same entry in another collection · chain A against A, TM-score 1.00

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