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MolNFT v1 · #156640 · protein

X-ray structure of branchiostoma floridae fluorescent protein LANFP10G

6MAS · Uncharacterized protein: “X-ray structure of branchiostoma floridae fluorescent protein LANFP10G”. X-ray diffraction, 1 ligand (CR2), 20 pockets (best druggability 0.87). MolNFT v1 #156640 on GenesisL1: 3D structure, binding sites…

PDB
6MAS
Type
protein
Length
1,720 residues
Chains
8
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Uncharacterized protein
UniProt
C3YRA2
Ligands
CR2
Pockets
20 · best druggability 0.87

Structure

x-ray diffraction · 1 distinct chain · 10% helix, 57% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, D, E, F, G, HUncharacterized proteinprotein21510% helix, 57% strandC3YRA2

Ligands and binding sites

  • CR2 · {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid · ligand · 8 copies · chains A, B, C, D, E, F, G, H
  • GOL · Glycerol · additive · 7 copies · chains B, C, D, E, F, G

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
110690.870.89112empty
29380.870.89105empty
31230.790.9834CR2
41110.770.9733CR2
5960.770.9832CR2

Interfaces

13 interfaces between chains.

  • B–D · 1220 Ų buried · 10 hydrogen bonds · protein-protein
  • A–C · 1204 Ų buried · 11 hydrogen bonds · protein-protein
  • F–G · 1176 Ų buried · 10 hydrogen bonds · protein-protein
  • E–H · 1174 Ų buried · 10 hydrogen bonds · protein-protein
  • G–H · 1007 Ų buried · 24 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 16 cofactor (chromophore).

Compared structures

  • 6MAS · X-ray Structure of Branchiostoma floridae fluorescent protein lanFP10G · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

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