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MolNFT v1 · #82669 · protein

Crystal structure of the C-terminal globular domain of oligosaccharyltransferase (phaglb-L, O74088_PYRHO) from pyrococcus horikoshii

3VU1 · Putative uncharacterized protein PH0242: “Crystal structure of the C-terminal globular domain of oligosaccharyltransferase (phaglb-L, O74088_PYRHO)…”. X-ray diffraction, 2 ligands (CA, CL), 14 pockets (best druggability 0.84).…

PDB
3VU1
Type
protein
Length
978 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Putative uncharacterized protein PH0242
EC
2.4.1.119
UniProt
O74088
Ligands
CA, CL
Pockets
14 · best druggability 0.84

Structure

x-ray diffraction · 2 distinct chains · 16% helix, 48% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APutative uncharacterized protein PH0242 (EC 2.4.1.119)protein48816% helix, 48% strandO74088
BPutative uncharacterized protein PH0242 (EC 2.4.1.119)protein49016% helix, 48% strandO74088

Ligands and binding sites

  • CA · Calcium ion · metal · 2 copies · chains A, B
  • CL · Chloride ion · ion · 2 copies · chains A, B

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

Pockets

14 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111170.840.8594empty
25550.720.8068empty
33990.680.8035empty
43890.670.8035empty
51200.540.8331empty

Interfaces

1 interface between chains.

  • A–B · 2016 Ų buried · 26 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 3VU1 · Crystal structure of the C-terminal globular domain of oligosaccharyltransferase… · the same entry in another collection · chain A against A, TM-score 1.00
  • O74088 · AlphaFold monomer V2.0 prediction for dolichyl- phosphooligosaccharide-protein… · a predicted model of the same protein · chain B against A, TM-score 0.97

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