GL1X · GenesisL1 explorer

MolNFT v1 · #12144 · protein

E. COLI meth C-terminal fragment (649-1227)

1K7Y · Methionine synthase: “E. COLI meth C-terminal fragment (649-1227)”. X-ray diffraction, 2 ligands (B12, SO4), 6 pockets (best druggability 0.72). MolNFT v1 #12144 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
1K7Y
Type
protein
Length
577 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Methionine synthase
EC
2.1.1.13
UniProt
P13009
Ligands
B12, SO4
Pockets
6 · best druggability 0.72

Structure

x-ray diffraction · 1 distinct chain · 48% helix, 13% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMethionine synthase (EC 2.1.1.13)protein57748% helix, 13% strandP13009

Ligands and binding sites

  • B12 · Cobalamin · ligand · chains A
  • SO4 · Sulfate ion · ion · 10 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15740.720.8068B12
22170.630.8240empty
32230.590.8026empty
4610.330.7714empty
5860.320.7317empty

Compared structures

  • 1K7Y · E. coli MetH C-terminal fragment (649-1227) · the same entry in another collection · chain A against A, TM-score 1.00
  • P13009 · AlphaFold monomer V2.0 prediction for methionine synthase (P13009) · a predicted model of the same protein · chain A against A, TM-score 0.99

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