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MolNFT v1 · #47938 · protein

1.7 ångström crystal structure of the photo-excited blue- light photoreceptor vivid

2PDR · Vivid pas protein vvd: “1.7 ångström crystal structure of the photo-excited blue- light photoreceptor vivid”. X-ray diffraction, 1 ligand (FAD), 8 pockets (best druggability 0.69). MolNFT v1 #47938 on GenesisL1: 3D structure…

PDB
2PDR
Type
protein
Length
588 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Vivid pas protein vvd
UniProt
Q9C3Y6
Ligands
FAD
Pockets
8 · best druggability 0.69

Structure

x-ray diffraction · 1 distinct chain · 26% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DVivid pas protein vvdprotein14726% helix, 26% strandQ9C3Y6

Ligands and binding sites

  • FAD · Flavin-adenine dinucleotide · ligand · 4 copies · chains A, B, C, D

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12100.690.8633FAD
22150.680.8630FAD
32200.680.8531FAD
42270.670.8431FAD
51910.450.7428empty

Interfaces

4 interfaces between chains.

  • A–D · 432 Ų buried · 6 hydrogen bonds · protein-protein
  • B–C · 419 Ų buried · 5 hydrogen bonds · protein-protein
  • C–D · 152 Ų buried · 0 hydrogen bonds · protein-protein
  • A–B · 109 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 cofactor (flavinylation).

Compared structures

  • 2PDR · 1.7 Angstrom Crystal Structure of the Photo-excited Blue-light Photoreceptor Vivid · the same entry in another collection · chain A against A, TM-score 1.00

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