GL1X · GenesisL1 explorer

MolNFT v1 · #82316 · protein

Crystal strcture of SWI5 from fission yeast

3VIR · Mating-type switching protein SWI5: “Crystal strcture of SWI5 from fission yeast”. X-ray diffraction, 3 pockets (best druggability 0.43). MolNFT v1 #82316 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
3VIR
Type
protein
Length
251 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Mating-type switching protein SWI5
UniProt
Q9UUB7
Pockets
3 · best druggability 0.43

Structure

x-ray diffraction · 4 distinct chains · 95% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMating-type switching protein SWI5protein6996% helix, 0% strandQ9UUB7
BMating-type switching protein SWI5protein6697% helix, 0% strandQ9UUB7
CMating-type switching protein SWI5protein5396% helix, 0% strandQ9UUB7
DMating-type switching protein SWI5protein6392% helix, 0% strandQ9UUB7

Ligands and binding sites

  • BOG · octyl beta-D-glucopyranoside · additive · 2 copies · chains B, D, C

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

Pockets

3 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11520.430.7520empty
2610.380.7913empty
3960.350.7418empty

Interfaces

6 interfaces between chains.

  • A–B · 1026 Ų buried · 13 hydrogen bonds · protein-protein
  • C–D · 883 Ų buried · 4 hydrogen bonds · protein-protein
  • A–C · 525 Ų buried · 0 hydrogen bonds · protein-protein
  • B–D · 489 Ų buried · 0 hydrogen bonds · protein-protein
  • A–D · 221 Ų buried · 1 hydrogen bond · protein-protein

Compared structures

  • 3VIR · Crystal strcture of Swi5 from fission yeast · the same entry in another collection · chain D against D, TM-score 1.00
  • Q9UUB7 · AlphaFold monomer V2.0 prediction for mating-type switching protein SWI5 (Q9UUB7) · a predicted model of the same protein · chain C against A, TM-score 0.63

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