GL1X · GenesisL1 explorer

MolNFT v1 · #156664 · protein

Gphf dehydratase P1711L variant for improved crystallization

6MBG: “Gphf dehydratase P1711L variant for improved crystallization”. X-ray diffraction, 1 ligand (MG), 3 pockets (best druggability 0.65). MolNFT v1 #156664 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6MBG
Type
protein
Length
280 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Gphf
UniProt
U6BSB2
Ligands
MG
Pockets
3 · best druggability 0.65

Structure

x-ray diffraction · 1 distinct chain · 21% helix, 41% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGphfprotein28021% helix, 41% strandU6BSB2

Ligands and binding sites

  • MG · Magnesium ion · metal · chains A
  • BU1 · 1,4-butanediol · additive · 3 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11380.650.8730BU1, MG
2580.370.7914BU1
3530.280.7516empty

Compared structures

  • 6MBG · GphF Dehydratase P1711L variant for improved crystallization · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

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