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MolNFT v1 · #146987 · protein

Crystal structure of helicobacter pylori 5'-METHYLTHIOADENOSINE/S- adenosyl homocysteine nucleosidase (mtan) complexed with (3R,4S)-1- ((4-amino-5H-PYRROLO[3,2-D]PYRIMIDIN-7-YL)METHYL)-4-(((3-(1-butyl-1H- 1,2,3-triazol-4-YL)PROPYL)THIO)METHYL)PYRROLIDIN-3-ol

6DYY: “Crystal structure of helicobacter pylori 5'-METHYLTHIOADENOSINE/S- adenosyl homocysteine nucleosidase (mtan)…”. X-ray diffraction, 2 ligands (OS6, MG). MolNFT v1 #146987 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6DYY
Type
protein
Length
924 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
A0A1W0VQJ9
Ligands
OS6, MG

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, D—protein232—A0A1W0VQJ9
B, C—protein230—A0A1W0VQJ9

Ligands and binding sites

  • OS6 · (3R,4S)-1-[(4-amino-5H-pyrrolo[3,2-d]pyrimidin-7-yl) methyl]-4-({[3-(1-butyl-1H-1,2,3-triazol-4-yl) propyl]sulfanyl}methyl)pyrrolidin-3-ol · ligand · 4 copies · chains A, B, C, D
  • MG · Magnesium ion · metal · 2 copies · chains B
  • EDO · 1,2-ethanediol · additive · 7 copies · chains A, B, D, C

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

Compared structures

  • 6DYY · Crystal structure of Helicobacter pylori 5'-methylthioadenosine/S-adenosyl homocysteine… · the same entry in another collection · chain D against D, TM-score 1.00

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