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3A7E

Crystal structure of human COMT complexed with SAM and 3,5-dinitrocatechol

Functional Information from GO Data
ChainGOidnamespacecontents
A0000287molecular_functionmagnesium ion binding
A0006584biological_processcatecholamine metabolic process
A0008171molecular_functionO-methyltransferase activity
A0016206molecular_functioncatechol O-methyltransferase activity
Functional Information from PDB Data
site_idAC1
Number of Residues5
DetailsBINDING SITE FOR RESIDUE MG A 215
ChainResidue
AASP141
AASP169
AASN170
ASAM216
ADNC217

site_idAC2
Number of Residues21
DetailsBINDING SITE FOR RESIDUE SAM A 216
ChainResidue
AALA67
ATYR68
ATYR71
ASER72
AILE89
AGLU90
AILE91
AGLY117
ASER119
AGLN120
AASP141
AHIS142
ATRP143
AARG146
AMG215
ADNC217
AHOH251
AMET40
AVAL42
AGLU64
AGLY66

site_idAC3
Number of Residues11
DetailsBINDING SITE FOR RESIDUE DNC A 217
ChainResidue
ATRP38
AASP141
AHIS142
ATRP143
ALYS144
AASP169
AASN170
APRO174
AGLU199
AMG215
ASAM216

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues4
DetailsBINDING: BINDING => ECO:0000255|PROSITE-ProRule:PRU01019, ECO:0000269|PubMed:18486144
ChainResidueDetails
AVAL42
ASER72
AGLU90
AASP141

site_idSWS_FT_FI2
Number of Residues3
DetailsBINDING: BINDING => ECO:0000255|PROSITE-ProRule:PRU01019
ChainResidueDetails
AGLU64
AILE91
ASER119

site_idSWS_FT_FI3
Number of Residues4
DetailsBINDING:
ChainResidueDetails
AGLY117
ALYS144
AASN170
AGLU199

site_idSWS_FT_FI4
Number of Residues1
DetailsBINDING: BINDING => ECO:0000269|PubMed:18486144
ChainResidueDetails
AASP169

218853

PDB entries from 2024-04-24

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