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MolNFT v1 · #100913 · protein

Crystal structure of uvb photoreceptor UVR8 and light-induced structural changes at 180K

4NBM · Ultraviolet-B receptor UVR8: “Crystal structure of uvb photoreceptor UVR8 and light-induced structural changes at 180K”. X-ray diffraction, 1 ligand (MG), 10 pockets (best druggability 0.83). MolNFT v1 #100913 on GenesisL1: 3D…

PDB
4NBM
Type
protein
Length
1,476 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ultraviolet-B receptor UVR8
UniProt
Q9FN03
Ligands
MG
Pockets
10 · best druggability 0.83

Structure

x-ray diffraction · 1 distinct chain · 6% helix, 44% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DUltraviolet-B receptor UVR8protein3696% helix, 44% strandQ9FN03

Ligands and binding sites

  • MG · Magnesium ion · metal · 23 copies · chains A, C, D, 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, 7 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15110.830.9064MG
25090.830.8967MG
35240.760.8446MG
44890.760.8446MG
54790.750.8447MG

Interfaces

5 interfaces between chains.

  • A–B · 1436 Ų buried · 38 hydrogen bonds · protein-protein
  • C–D · 1422 Ų buried · 37 hydrogen bonds · protein-protein
  • A–C · 303 Ų buried · 2 hydrogen bonds · protein-protein
  • B–C · 16 Ų buried · 0 hydrogen bonds · protein-protein
  • A–D · 12 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 4NBM · Crystal structure of UVB photoreceptor UVR8 and light-induced structural changes at 180K · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9FN03 · AlphaFold monomer V2.0 prediction for ultraviolet-B receptor UVR8 (Q9FN03) · a predicted model of the same protein · chain A against A, TM-score 1.00

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