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MolNFT v1 · #24297 · protein

Xylanase XYN10B mutant (E262S) from cellvibrio mixtus in complex with xylopentaose

1UQY · Endoxylanase: “Xylanase XYN10B mutant (E262S) from cellvibrio mixtus in complex with xylopentaose”. X-ray diffraction, 3 ligands (XYP, XYS, MG), 1 pocket (best druggability 0.60). MolNFT v1 #24297 on GenesisL1: 3D structure, binding…

PDB
1UQY
Type
protein
Length
347 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Endoxylanase
EC
3.2.1.8
UniProt
O68541
Ligands
XYP, XYS, MG
Pockets
1 · best druggability 0.60

Structure

x-ray diffraction · 1 distinct chain · 42% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AEndoxylanase (EC 3.2.1.8)protein34742% helix, 18% strandO68541

Ligands and binding sites

  • XYP · beta-D-xylopyranose · sugar · 6 copies · chains A
  • XYS · alpha-D-xylopyranose · sugar · chains A
  • MG · Magnesium ion · metal · 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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12970.600.7838XYS, XYP

Compared structures

  • 1UQY · Xylanase Xyn10B mutant (E262S) from Cellvibrio mixtus in complex with xylopentaose · the same entry in another collection · chain A against A, TM-score 1.00

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