ISDA: 5LQU

Deposition Date 2016-08-17

Release Date 2016-10-05

Last Version Date 2024-05-01

Entry Detail

PDB ID:

5LQU

Keywords:

TRANSFERASE

Title:

Crystal Structure of COMT in complex with N-[(E)-3-[(2R,3S,4R,5R)-5-[6-(ethylamino)purin-9-yl]-3,4-dihydroxyoxolan-2-yl]prop-2-enyl]-5-(4-fluorophenyl)-2,3-dihydroxybenzamide

Biological Source:

Source Organism(s):

Rattus norvegicus (Taxon ID: 10116)

Expression System(s):

Escherichia coli bl21(de3)

Method Details:

Experimental Method:

X-RAY DIFFRACTION

Resolution:

1.80 Å

R-Value Free:

0.20

R-Value Work:

0.16

R-Value Observed:

0.16

Space Group:

P 21 21 21

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Macromolecular Entities

Structures with similar UniProt ID

Protein Blast

Polymer Type:polypeptide(L)
Molecule:Catechol O-methyltransferase
Gene (Uniprot):Comt
Chain IDs:A, B
Chain Length:221
Number of Molecules:2
Biological Source:Rattus norvegicus

UniProt ID:P22734 Pfam ID:PF01596 EC:2.1.1.6

Ligand Molecules

619

BTB

Primary Citation

Crystal Structure of COMT in complex with N-[(E)-3-[(2R,3S,4R,5R)-5-[6-(ethylamino)purin-9-yl]-3,4-dihydroxyoxolan-2-yl]prop-2-enyl]-5-(4-fluorophenyl)-2,3-dihydroxybenzamide

Lerner, C, Ellermann, M, Rudolph, M.G.Show

To be published ? ? ? (?)

Primary Citation of related structures

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