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MolNFT v1 · #53656 · protein

Crystal structure of IMPORTIN13 - rangtp complex

2X19 · GTP-binding nuclear protein GSP1/CNR1: “Crystal structure of IMPORTIN13 - rangtp complex”. X-ray diffraction, 2 ligands (GTP, MG), 10 pockets (best druggability 0.80). MolNFT v1 #53656 on GenesisL1: 3D structure, binding sites and…

PDB
2X19
Type
protein
Length
1,078 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
GTP-binding nuclear protein GSP1/CNR1; Importin-13
UniProt
P32835, O94829
Ligands
GTP, MG
Pockets
10 · best druggability 0.80

Structure

x-ray diffraction · 2 distinct chains · 68% helix, 4% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGTP-binding nuclear protein GSP1/CNR1protein17228% helix, 28% strandP32835
BImportin-13protein90676% helix, 0% strandO94829

Ligands and binding sites

  • GTP · Guanosine-5'-triphosphate · ligand · chains A
  • MG · Magnesium ion · metal · chains A

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

Pockets

10 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110640.800.8296GTP, MG
211240.760.78100empty
3530.620.9322empty
42230.480.7428empty
5600.430.8213empty

Interfaces

1 interface between chains.

  • A–B · 1682 Ų buried · 22 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 22 modified (engineered).

Compared structures

  • 2X19 · Crystal structure of Importin13 - RanGTP complex · the same entry in another collection · chain A against A, TM-score 1.00
  • O94829 · AlphaFold monomer V2.0 prediction for importin-13 (O94829) · a predicted model of the same protein · chain B against A, TM-score 0.97
  • P32835 · AlphaFold monomer V2.0 prediction for GTP-binding nuclear protein GSP1/CNR1 (P32835) · a predicted model of the same protein · chain A against A, TM-score 0.96

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