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MolNFT v1 · #124598 · protein

Crystal structure of arabidopsis thaliana hct in complex with P- coumaroylshikimate

5KJU: “Crystal structure of arabidopsis thaliana hct in complex with P- coumaroylshikimate”. X-ray diffraction, 1 ligand (6TO). MolNFT v1 #124598 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5KJU
Type
protein
Length
431 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q9FI78
Ligands
6TO

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein431—Q9FI78

Ligands and binding sites

  • 6TO · (3~{R},4~{S},5~{R})-3-[(~{E})-3-(4-hydroxyphenyl)prop-2-enoyl]oxy-4,5-bis(oxidanyl)cyclohexene-1-carboxylic acid · ligand · chains A

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

Compared structures

  • 5KJU · Crystal structure of Arabidopsis thaliana HCT in complex with p-coumaroylshikimate · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9FI78 · AlphaFold monomer V2.0 prediction for shikimate O-hydroxycinnamoyltransferase (Q9FI78) · a predicted model of the same protein · chain A against A, TM-score 0.99

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