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MolNFT v1 · #106304 · protein

Crystal structure of mtmc in complex with sah

4RV9 · D-mycarose 3-C-methyltransferase: “Crystal structure of mtmc in complex with sah”. X-ray diffraction, 3 ligands (SAH, ZN, CL), 1 pocket (best druggability 0.83). MolNFT v1 #106304 on GenesisL1: 3D structure, binding sites and…

PDB
4RV9
Type
protein
Length
419 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
D-mycarose 3-C-methyltransferase
Ligands
SAH, ZN, CL
Pockets
1 · best druggability 0.83

Structure

x-ray diffraction · 1 distinct chain · 38% helix, 22% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AD-mycarose 3-C-methyltransferaseprotein41938% helix, 22% strand—

Ligands and binding sites

  • SAH · S-adenosyl-L-homocysteine · ligand · chains A
  • ZN · Zinc ion · metal · chains A
  • CL · Chloride ion · ion · chains A
  • ACT · Acetate ion · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110660.830.8488SAH, CL

Modifications

Observed in the structure: 1 modified (oxidation).

Compared structures

  • 4RV9 · Crystal structure of MtmC in complex with SAH · the same entry in another collection · chain A against A, TM-score 1.00

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