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MolNFT v1 · #185811 · protein

Co-crystal structure of UPF3A-rrm-nops-L with UPF2-MIF4GIII

7QG6 · Regulator of nonsense transcripts 3A: “Co-crystal structure of UPF3A-rrm-nops-L with UPF2-MIF4GIII”. X-ray diffraction, 1 ligand (CL), 16 pockets (best druggability 0.82). MolNFT v1 #185811 on GenesisL1: 3D structure, binding sites…

PDB
7QG6
Type
protein
Length
1,458 residues
Chains
8
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Regulator of nonsense transcripts 3A; Regulator of nonsense transcripts 2
UniProt
Q9H1J1, Q9HAU5
Ligands
CL
Pockets
16 · best druggability 0.82

Structure

x-ray diffraction · 8 distinct chains · 54% helix, 8% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
CRegulator of nonsense transcripts 3Aprotein11724% helix, 26% strandQ9H1J1
DRegulator of nonsense transcripts 2protein24570% helix, 0% strandQ9HAU5
ARegulator of nonsense transcripts 3Aprotein12322% helix, 25% strandQ9H1J1
BRegulator of nonsense transcripts 2protein24870% helix, 0% strandQ9HAU5
ERegulator of nonsense transcripts 3Aprotein11925% helix, 24% strandQ9H1J1
FRegulator of nonsense transcripts 2protein24669% helix, 0% strandQ9HAU5
GRegulator of nonsense transcripts 3Aprotein11620% helix, 27% strandQ9H1J1
HRegulator of nonsense transcripts 2protein24470% helix, 1% strandQ9HAU5

Ligands and binding sites

  • CL · Chloride ion · ion · chains F
  • PGE · Triethylene glycol · additive · 3 copies · chains D, B, F

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

Pockets

16 pockets found on a 1 Å grid, 10 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19910.820.83116empty
22320.770.9135empty
31440.700.9021empty
42190.670.8531empty
51680.640.8529empty

Interfaces

10 interfaces between chains.

  • A–B · 1794 Ų buried · 21 hydrogen bonds · protein-protein
  • E–F · 1663 Ų buried · 21 hydrogen bonds · protein-protein
  • C–D · 1634 Ų buried · 28 hydrogen bonds · protein-protein
  • G–H · 1618 Ų buried · 23 hydrogen bonds · protein-protein
  • D–B · 747 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 7QG6 · Co-crystal structure of UPF3A-RRM-NOPS-L with UPF2-MIF4GIII · the same entry in another collection · chain H against H, TM-score 1.00
  • Q9HAU5 · AlphaFold monomer V2.0 prediction for regulator of nonsense transcripts 2 (Q9HAU5) · a predicted model of the same protein · chain F against A, TM-score 0.99

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