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MolNFT v1 · #124818 · protein

Solution structure of antibiotic-resistance factor ANT(2'')-ia reveals substrate-regulated conformation dynamics

5KQJ · 2''-aminoglycoside nucleotidyltransferase: “Solution structure of antibiotic-resistance factor ANT(2'')-ia reveals substrate-regulated conformation…”. Solution nmr, 1 pocket (best druggability 0.60). MolNFT v1 #124818 on GenesisL1…

PDB
5KQJ
Type
protein
Length
185 residues
Chains
1
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
2''-aminoglycoside nucleotidyltransferase
EC
2.7.7.46
UniProt
P0AE05
Pockets
1 · best druggability 0.60

Structure

solution nmr · 1 distinct chain · 50% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A2''-aminoglycoside nucleotidyltransferase (EC 2.7.7.46)protein18550% helix, 23% strandP0AE05

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12910.600.7935empty

Compared structures

  • 5KQJ · Solution Structure of Antibiotic-Resistance Factor ANT(2'')-Ia Reveals… · the same entry in another collection · chain A against A, TM-score 1.00
  • P0AE05 · AlphaFold monomer V2.0 prediction for 2''-aminoglycoside nucleotidyltransferase (P0AE05) · a predicted model of the same protein · chain A against A, TM-score 0.93

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