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6NRJ

Crystal Structure of human PARP-1 ART domain bound to inhibitor UTT93

Functional Information from GO Data
ChainGOidnamespacecontents
A0003950molecular_functionNAD+ ADP-ribosyltransferase activity
Functional Information from PDB Data
site_idAC1
Number of Residues16
Detailsbinding site for residue KYJ A 1101
ChainResidue
AHIS862
ASER904
ATYR907
ADMS1107
ADMS1108
AHOH1208
AHOH1218
AHOH1222
AGLY863
AARG878
AALA880
APRO881
AGLY888
ATYR889
ATYR896
APHE897

site_idAC2
Number of Residues7
Detailsbinding site for residue SO4 A 1102
ChainResidue
ALYS764
ALYS766
ALYS903
ALEU984
ALEU985
ATYR986
AHOH1233

site_idAC3
Number of Residues3
Detailsbinding site for residue SO4 A 1103
ChainResidue
AASN906
ATYR907
AHIS909

site_idAC4
Number of Residues6
Detailsbinding site for residue SO4 A 1104
ChainResidue
AARG806
ALYS953
AASN980
AASP981
ATHR982
AHOH1221

site_idAC5
Number of Residues5
Detailsbinding site for residue SO4 A 1105
ChainResidue
AGLU840
ALYS849
AASN998
ALYS1000
AHOH1216

site_idAC6
Number of Residues7
Detailsbinding site for residue SO4 A 1106
ChainResidue
AARG858
AMET929
ALYS949
AHOH1205
AHOH1258
AHOH1274
AHOH1307

site_idAC7
Number of Residues8
Detailsbinding site for residue DMS A 1107
ChainResidue
AHIS862
AARG878
ATYR889
AGLY894
AILE895
ATYR896
AKYJ1101
ADMS1108

site_idAC8
Number of Residues4
Detailsbinding site for residue DMS A 1108
ChainResidue
AKYJ1101
ADMS1107
AHOH1234
AHOH1278

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues1
DetailsACT_SITE: For poly [ADP-ribose] polymerase activity => ECO:0000305|PubMed:32028527, ECO:0000305|PubMed:7852410, ECO:0000305|PubMed:9315851
ChainResidueDetails
AGLU988

site_idSWS_FT_FI2
Number of Residues4
DetailsBINDING: BINDING => ECO:0000250|UniProtKB:Q9UGN5
ChainResidueDetails
AHIS862
AGLY871
AARG878
ASER904

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PDB entries from 2024-03-27

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