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MolNFT v1 · #149300 · protein

Structure of the GH99 endo-alpha-mannanase from bacteroides xylanisolvens in complex with alpha-glc-1,3-(1,2-anhydro-carba- mannosamine)

6FWI · Glycosyl hydrolase family 71: “Structure of the GH99 endo-alpha-mannanase from bacteroides xylanisolvens in complex with…”. X-ray diffraction, 2 ligands (E9K, GLC), 1 pocket (best druggability 0.48). MolNFT v1 #149300 on GenesisL1…

PDB
6FWI
Type
protein
Length
343 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glycosyl hydrolase family 71
UniProt
D6D1V7
Ligands
E9K, GLC
Pockets
1 · best druggability 0.48

Structure

x-ray diffraction · 1 distinct chain · 33% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGlycosyl hydrolase family 71protein34333% helix, 17% strandD6D1V7

Ligands and binding sites

  • E9K · (1~{R},2~{R},3~{R},4~{R},6~{R})-4-(hydroxymethyl)-7-azabicyclo[4.1.0]heptane-2,3-diol · ligand · chains A
  • GLC · alpha-D-glucopyranose · sugar · chains A
  • ACT · Acetate ion · additive · 4 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11520.480.7726E9K, GLC

Compared structures

  • 6FWI · 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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