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X-ray structure of the monoclinic crystal form at 2.48 a resolution of lipase from thermomyces (humicola) lanuginosa at 298 K

Analyse X-ray structure of the monoclinic crystal form at 2.48 a resolution of lipase… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6XS3
Type
protein
Length
1,614 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
O59952
Ligands
OCA, LTV, NAG, CA, PO4

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, E, D, F—protein269—O59952

Ligands and binding sites

  • OCA · Octanoic acid (caprylic acid) · ligand · 6 copies · chains A, D, B, E, C, F
  • LTV · 2-hydroxy-3-(octadecanoyloxy)propyl pentacosanoate · ligand · 6 copies · chains A, F, B, C, E, D
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 6 copies · chains A, B, C, E, D, F
  • CA · Calcium ion · metal · 8 copies · chains A, B, C, E, D, F
  • PO4 · Phosphate ion · ion · 5 copies · chains A, B, E, D

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

Compared structures

  • 6XS3 · X-ray structure of the monoclinic crystal form at 2.48 A resolution of lipase from… · the same entry in another collection · chain F against F, TM-score 1.00
  • O59952 · AlphaFold monomer V2.0 prediction for lipase (O59952) · a predicted model of the same protein · chain A against A, TM-score 0.98

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