GL1X · GenesisL1 explorer

MolNFT v1 · #38642 · protein

Karyopherin BETA2/TRANSPORTIN-M9NLS

2H4M · Transportin-1: “Karyopherin BETA2/TRANSPORTIN-M9NLS”. X-ray diffraction, 15 pockets (best druggability 0.67). MolNFT v1 #38642 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
2H4M
Type
protein
Length
1,687 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Transportin-1; Heterogeneous nuclear ribonucleoprotein A1
UniProt
Q92973, P09651
Pockets
15 · best druggability 0.67

Structure

x-ray diffraction · 4 distinct chains · 73% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATransportin-1protein82777% helix, 0% strandQ92973
BTransportin-1protein81074% helix, 0% strandQ92973
CHeterogeneous nuclear ribonucleoprotein A1protein230% helix, 4% strandP09651
DHeterogeneous nuclear ribonucleoprotein A1protein270% helix, 4% strandP09651

Pockets

15 pockets found on a 1 Å grid, 8 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13240.670.8229empty
25280.670.7750empty
32750.640.8136empty
42950.580.7842empty
51250.550.8221empty

Interfaces

3 interfaces between chains.

  • B–D · 1828 Ų buried · 28 hydrogen bonds · protein-protein
  • A–C · 1468 Ų buried · 27 hydrogen bonds · protein-protein
  • A–B · 800 Ų buried · 11 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 2H4M · Karyopherin Beta2/Transportin-M9NLS · the same entry in another collection · chain D against D, TM-score 1.00
  • Q92973 · AlphaFold monomer V2.0 prediction for transportin-1 (Q92973) · a predicted model of the same protein · chain B against A, TM-score 0.95
  • P09651 · AlphaFold monomer V2.0 prediction for heterogeneous nuclear ribonucleoprotein A1 (P09651) · a predicted model of the same protein · chain D against A, TM-score 0.24

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