GL1X · GenesisL1 explorer

MolNFT v1 · #103651 · protein

Structure of S. pombe PCT1 RNA triphosphatase

4PN0 · MRNA-capping enzyme subunit beta: “Structure of S. pombe PCT1 RNA triphosphatase”. X-ray diffraction, 7 pockets (best druggability 0.68). MolNFT v1 #103651 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4PN0
Type
protein
Length
1,034 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
MRNA-capping enzyme subunit beta
EC
3.1.3.33
UniProt
Q9P6Q6
Pockets
7 · best druggability 0.68

Structure

x-ray diffraction · 4 distinct chains · 25% helix, 38% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMRNA-capping enzyme subunit beta (EC 3.1.3.33)protein26126% helix, 38% strandQ9P6Q6
BMRNA-capping enzyme subunit beta (EC 3.1.3.33)protein26026% helix, 38% strandQ9P6Q6
CMRNA-capping enzyme subunit beta (EC 3.1.3.33)protein25625% helix, 38% strandQ9P6Q6
DMRNA-capping enzyme subunit beta (EC 3.1.3.33)protein25723% helix, 38% strandQ9P6Q6

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14920.680.7954empty
24910.670.7854empty
34160.600.7635empty
43980.590.7649empty
53990.590.7648empty

Interfaces

2 interfaces between chains.

  • A–B · 2161 Ų buried · 41 hydrogen bonds · protein-protein
  • C–D · 2145 Ų buried · 38 hydrogen bonds · protein-protein

Compared structures

  • 4PN0 · Structure of S. pombe Pct1 RNA triphosphatase · the same entry in another collection · chain D against D, TM-score 1.00
  • Q9P6Q6 · AlphaFold monomer V2.0 prediction for mRNA-capping enzyme subunit beta (Q9P6Q6) · a predicted model of the same protein · chain B against A, TM-score 0.98

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