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Crystal structure and functional analysis of drosophila wind-- a pdi- related protein

Analyse Crystal structure and functional analysis of drosophila wind-- a pdi- related… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1OVN
Type
protein
Length
455 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Windbeutel
UniProt
O44342
Ligands
CS
Pockets
5 · best druggability 0.53

Structure

x-ray diffraction · 2 distinct chains · 49% helix, 12% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AWindbeutelprotein22950% helix, 11% strandO44342
BWindbeutelprotein22648% helix, 12% strandO44342

Ligands and binding sites

  • CS · Cesium ion · metal · chains B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13010.530.7546empty
21450.450.7730empty
3810.370.7617empty
4600.260.7213empty
5500.260.7312empty

Interfaces

1 interface between chains.

  • A–B · 770 Ų buried · 7 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 1OVN · Crystal Structure and Functional Analysis of Drosophila Wind-- a PDI-Related Protein · the same entry in another collection · chain A against A, TM-score 1.00
  • O44342 · AlphaFold monomer V2.0 prediction for protein windbeutel (O44342) · a predicted model of the same protein · chain B against A, TM-score 0.95

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