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MolNFT v1 · #180923 · protein

Structure of importin A3 bound to the P50- and P65-nlss

7LF4 · Importin subunit alpha-3: “Structure of importin A3 bound to the P50- and P65-nlss”. X-ray diffraction, 7 pockets (best druggability 0.51). MolNFT v1 #180923 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7LF4
Type
protein
Length
881 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Importin subunit alpha-3; Nuclear factor nf-kappa-B P105 subunit; Transcription factor P65
UniProt
O00629, P19838, Q04206
Pockets
7 · best druggability 0.51

Structure

x-ray diffraction · 4 distinct chains · 68% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, CImportin subunit alpha-3protein41674% helix, 0% strandO00629
B, FNuclear factor nf-kappa-B P105 subunitprotein110% helix, 0% strandP19838
DTranscription factor P65protein140% helix, 0% strandQ04206
ETranscription factor P65protein130% helix, 0% strandQ04206

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1760.510.8515empty
21640.440.7527empty
31420.430.7523empty
41140.380.7418empty
5870.370.7617empty

Interfaces

5 interfaces between chains.

  • A–B · 875 Ų buried · 16 hydrogen bonds · protein-protein
  • C–F · 836 Ų buried · 19 hydrogen bonds · protein-protein
  • C–D · 714 Ų buried · 9 hydrogen bonds · protein-protein
  • A–C · 615 Ų buried · 3 hydrogen bonds · protein-protein
  • A–E · 589 Ų buried · 14 hydrogen bonds · protein-protein

Compared structures

  • 7LF4 · Structure of importin a3 bound to the p50- and p65-NLSs · the same entry in another collection · chain E against E, TM-score 1.00
  • O00629 · AlphaFold monomer V2.0 prediction for importin subunit alpha-3 (O00629) · a predicted model of the same protein · chain A against A, TM-score 0.99
  • P19838 · AlphaFold monomer V2.0 prediction for nuclear factor nf-kappa-B P105 subunit (P19838) · a predicted model of the same protein · chain B against A, TM-score 0.43
  • Q04206 · AlphaFold monomer V2.0 prediction for transcription factor P65 (Q04206) · a predicted model of the same protein · chain E against A, TM-score 0.30

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