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Crystal structure of xylanase from streptomyces olivaceoviridis E-86 complexed with 2(2)-4-O-methyl-alpha-D-glucuronosyl-xylobiose

Analyse Crystal structure of xylanase from streptomyces olivaceoviridis E-86 complexed… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1V6W
Type
protein
Length
872 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Endo-1,4-beta-D-xylanase
EC
3.2.1.8
UniProt
Q7SI98
Ligands
GCV, XYP
Pockets
6 · best druggability 0.66

Structure

x-ray diffraction · 1 distinct chain · 32% helix, 25% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BEndo-1,4-beta-D-xylanase (EC 3.2.1.8)protein43632% helix, 25% strandQ7SI98

Ligands and binding sites

  • GCV · 4-O-methyl-alpha-D-glucopyranuronic acid · ligand · 2 copies
  • XYP · beta-D-xylopyranose · sugar · 8 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16520.660.7672empty
23380.650.8048empty
34790.630.7647empty
4570.320.7615empty
5700.320.7519XYP

Interfaces

1 interface between chains.

  • A–B · 1121 Ų buried · 12 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 10 disulfide (disulfide).

Compared structures

  • 1V6W · Crystal Structure Of Xylanase From Streptomyces Olivaceoviridis E-86 Complexed With… · the same entry in another collection · chain A against A, TM-score 1.00

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