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Crystal structure analysis of dispersin B

Analyse Crystal structure analysis of dispersin B in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1YHT
Type
protein
Length
344 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Dspb
EC
3.2.1.52
Pockets
4 · best druggability 0.52

Structure

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

ChainMoleculeTypeResiduesSecondary structureUniProt
ADspb (EC 3.2.1.52)protein34442% helix, 18% strand—

Ligands and binding sites

  • GOL · Glycerol · additive · 2 copies · chains A
  • ACY · Acetic acid · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11430.520.8018empty
2820.400.7816ACY, GOL
3510.370.8015empty
4670.320.7517empty

Compared structures

  • 1YHT · Crystal structure analysis of Dispersin B · the same entry in another collection · chain A against A, TM-score 1.00

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