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Green-fluorescent variant of the non-fluorescent chromoprotein RTMS5

Analyse Green-fluorescent variant of the non-fluorescent chromoprotein RTMS5 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3VIC
Type
protein
Length
1,741 residues
Chains
8
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
GFP-like non-fluorescent chromoprotein
UniProt
P83690
Ligands
QFG, CL, IOD
Pockets
20 · best druggability 0.81

Structure

x-ray diffraction · 2 distinct chains · 5% helix, 57% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, E, HGFP-like non-fluorescent chromoproteinprotein2175% helix, 58% strandP83690
B, C, D, F, GGFP-like non-fluorescent chromoproteinprotein2185% helix, 57% strandP83690

Ligands and binding sites

  • QFG · {(4E)-2-[(1E)-4-amino-4-oxobutanimidoyl]-4-benzylidene-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid · ligand · 8 copies · chains A, B, C, D, E, F, G, H
  • CL · Chloride ion · ion · 16 copies · chains A, C, B, D, E, G, F, H
  • IOD · Iodide ion · ion · 8 copies · chains A, E, B, C, D, H

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

Pockets

20 pockets found on a 1 Å grid, 14 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18570.810.8399CL
28350.800.83102CL
3650.740.9927QFG
4650.730.9823QFG
5650.730.9824QFG

Interfaces

9 interfaces between chains.

  • A–B · 1286 Ų buried · 17 hydrogen bonds · protein-protein
  • C–D · 1285 Ų buried · 12 hydrogen bonds · protein-protein
  • G–H · 1279 Ų buried · 13 hydrogen bonds · protein-protein
  • E–F · 1275 Ų buried · 13 hydrogen bonds · protein-protein
  • F–H · 875 Ų buried · 8 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 16 covalent (covalent ligand).

Compared structures

  • 3VIC · Green-fluorescent variant of the non-fluorescent chromoprotein Rtms5 · the same entry in another collection · chain H against H, TM-score 1.00
  • P83690 · AlphaFold monomer V2.0 prediction for GFP-like non-fluorescent chromoprotein (P83690) · a predicted model of the same protein · chain A against A, TM-score 1.00

Analyse

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