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MolNFT v1 · #121574 · protein

Crystal structure of photoinhibitable INTERSECTIN1 containing wildtype LOV2 domain

5HZJ · Intersectin-1,NPH1-1,INTERSECTIN-1: “Crystal structure of photoinhibitable INTERSECTIN1 containing wildtype LOV2 domain”. X-ray diffraction, 1 ligand (FMN), 10 pockets (best druggability 0.74). MolNFT v1 #121574 on GenesisL1: 3D…

PDB
5HZJ
Type
protein
Length
952 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Intersectin-1,NPH1-1,INTERSECTIN-1
UniProt
Q15811, O49003
Ligands
FMN
Pockets
10 · best druggability 0.74

Structure

x-ray diffraction · 1 distinct chain · 49% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BIntersectin-1,NPH1-1,INTERSECTIN-1protein47649% helix, 18% strandQ15811, O49003

Ligands and binding sites

  • FMN · Flavin mononucleotide · ligand · 2 copies · chains A, B

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

Pockets

10 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15290.740.8266empty
24160.730.8337FMN
34810.720.8154empty
41900.700.8723FMN
52100.490.7522empty

Interfaces

1 interface between chains.

  • A–B · 313 Ų buried · 3 hydrogen bonds · protein-protein

Compared structures

  • 5HZJ · Crystal structure of photoinhibitable Intersectin1 containing wildtype LOV2 domain · the same entry in another collection · chain A against A, TM-score 1.00
  • Q15811 · AlphaFold monomer V2.0 prediction for intersectin-1 (Q15811) · a predicted model of the same protein · chain A against A, TM-score 0.46

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