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Crystal structures of the luciferase and green fluorescent protein from renilla reniformis

Analyse Crystal structures of the luciferase and green fluorescent protein from renilla… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2RH7
Type
protein
Length
845 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Green fluorescent protein
UniProt
Q963I9
Ligands
CRO
Pockets
8 · best druggability 0.75

Structure

x-ray diffraction · 2 distinct chains · 4% helix, 57% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, C, DGreen fluorescent proteinprotein2113% helix, 57% strandQ963I9
BGreen fluorescent proteinprotein2125% helix, 58% strandQ963I9

Ligands and binding sites

  • CRO · {2-[(1R,2R)-1-amino-2-hydroxypropyl]-4-(4-hydroxybenzylidene)-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid · 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, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111080.750.78102empty
2680.740.9922CRO
3640.720.9823CRO
4860.370.7616empty
5960.370.7519empty

Interfaces

5 interfaces between chains.

  • A–B · 1339 Ų buried · 18 hydrogen bonds · protein-protein
  • C–D · 1327 Ų buried · 19 hydrogen bonds · protein-protein
  • A–C · 168 Ų buried · 3 hydrogen bonds · protein-protein
  • B–D · 162 Ų buried · 2 hydrogen bonds · protein-protein
  • B–C · 83 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 2RH7 · Crystal Structures of the Luciferase and Green Fluorescent Protein from Renilla Reniformis · the same entry in another collection · chain A against A, TM-score 1.00

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