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MolNFT v1 · #55215 · RNA

Crystal structure of the SAM-I riboswitch A94G U34 G18U G19U variant in complex with SAM

2YDH: “Crystal structure of the SAM-I riboswitch A94G U34 G18U G19U variant in complex with SAM”. X-ray diffraction, 2 ligands (SAM, BA), 3 pockets (best druggability 0.75). MolNFT v1 #55215 on GenesisL1: 3D structure, binding sites and…

PDB
2YDH
Type
RNA
Length
94 nucleotides
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
SAM-I riboswitch
Ligands
SAM, BA
Pockets
3 · best druggability 0.75

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
ASAM-I riboswitchrna94——

Ligands and binding sites

  • SAM · S-adenosylmethionine · ligand · chains A
  • BA · Barium ion · metal · 5 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, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19730.750.7945BA, SAM
25780.620.7532empty
31210.350.7314BA

Compared structures

  • 2YDH · Crystal structure of the SAM-I riboswitch A94G U34 G18U G19U variant in complex with SAM · the same entry in another collection · chain A against A, TM-score 1.00

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