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Solution structure of the thiolation-thioesterase di-domain of enterobactin synthetase component F

Analyse Solution structure of the thiolation-thioesterase di-domain of enterobactin… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2ROQ
Type
protein
Length
343 residues
Chains
1
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Enterobactin synthetase component F
EC
2.7.7.-
UniProt
P11454
Pockets
9 · best druggability 0.84

Structure

solution nmr · 1 distinct chain · 38% helix, 10% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AEnterobactin synthetase component F (EC 2.7.7.-)protein34338% helix, 10% strandP11454

Pockets

9 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13070.840.9445empty
23460.760.8757empty
31130.730.9324empty
42730.570.7724empty
51230.520.8125empty

Compared structures

  • 2ROQ · Solution Structure of the thiolation-thioesterase di-domain of enterobactin synthetase… · the same entry in another collection · chain A against A, TM-score 1.00
  • P11454 · AlphaFold monomer V2.0 prediction for enterobactin synthase component F (P11454) · a predicted model of the same protein · chain A against A, TM-score 0.67

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