1R45
ADP-ribosyltransferase C3bot2 from Clostridium botulinum, triclinic form
Functional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0005576 | cellular_component | extracellular region |
| A | 0016757 | molecular_function | glycosyltransferase activity |
| A | 0016763 | molecular_function | pentosyltransferase activity |
| A | 0016779 | molecular_function | nucleotidyltransferase activity |
| A | 1990404 | molecular_function | NAD+-protein ADP-ribosyltransferase activity |
| B | 0005576 | cellular_component | extracellular region |
| B | 0016757 | molecular_function | glycosyltransferase activity |
| B | 0016763 | molecular_function | pentosyltransferase activity |
| B | 0016779 | molecular_function | nucleotidyltransferase activity |
| B | 1990404 | molecular_function | NAD+-protein ADP-ribosyltransferase activity |
| C | 0005576 | cellular_component | extracellular region |
| C | 0016757 | molecular_function | glycosyltransferase activity |
| C | 0016763 | molecular_function | pentosyltransferase activity |
| C | 0016779 | molecular_function | nucleotidyltransferase activity |
| C | 1990404 | molecular_function | NAD+-protein ADP-ribosyltransferase activity |
| D | 0005576 | cellular_component | extracellular region |
| D | 0016757 | molecular_function | glycosyltransferase activity |
| D | 0016763 | molecular_function | pentosyltransferase activity |
| D | 0016779 | molecular_function | nucleotidyltransferase activity |
| D | 1990404 | molecular_function | NAD+-protein ADP-ribosyltransferase activity |
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 11 |
| Details | BINDING SITE FOR RESIDUE SO4 A 1003 |
| Chain | Residue |
| A | ARG91 |
| B | HOH1142 |
| B | HOH1153 |
| A | ARG167 |
| A | GOL1001 |
| A | HOH1039 |
| A | HOH1053 |
| A | HOH1181 |
| B | GLN94 |
| B | TYR170 |
| B | HOH1069 |
| site_id | AC2 |
| Number of Residues | 12 |
| Details | BINDING SITE FOR RESIDUE SO4 B 1004 |
| Chain | Residue |
| A | GLN94 |
| A | TYR170 |
| B | ARG91 |
| B | ARG167 |
| B | GOL1002 |
| B | HOH1038 |
| B | HOH1050 |
| B | HOH1051 |
| B | HOH1142 |
| B | HOH1153 |
| B | HOH1154 |
| B | HOH1250 |
| site_id | AC3 |
| Number of Residues | 8 |
| Details | BINDING SITE FOR RESIDUE SO4 A 1005 |
| Chain | Residue |
| A | ALA83 |
| A | SER84 |
| A | ASN87 |
| A | ARG91 |
| A | HOH1127 |
| A | HOH1156 |
| A | HOH1186 |
| B | HOH1146 |
| site_id | AC4 |
| Number of Residues | 8 |
| Details | BINDING SITE FOR RESIDUE SO4 B 1006 |
| Chain | Residue |
| B | ALA83 |
| B | SER84 |
| B | ASN87 |
| B | ARG91 |
| B | HOH1119 |
| B | HOH1149 |
| B | HOH1173 |
| B | HOH1220 |
| site_id | AC5 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE SO4 C 1007 |
| Chain | Residue |
| C | ALA83 |
| C | SER84 |
| C | ASN87 |
| C | ARG91 |
| C | HOH1086 |
| C | HOH1113 |
| C | HOH1176 |
| site_id | AC6 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE SO4 D 1008 |
| Chain | Residue |
| D | ALA83 |
| D | SER84 |
| D | ASN87 |
| D | ARG91 |
| D | HOH1095 |
| D | HOH1118 |
| site_id | AC7 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE SO4 A 1009 |
| Chain | Residue |
| A | LYS64 |
| A | GLN228 |
| A | HOH1061 |
| A | HOH1229 |
| site_id | AC8 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE SO4 B 1010 |
| Chain | Residue |
| B | SER116 |
| B | LYS119 |
| B | LYS198 |
| B | HOH1249 |
| site_id | AC9 |
| Number of Residues | 10 |
| Details | BINDING SITE FOR RESIDUE GOL A 1001 |
| Chain | Residue |
| A | ARG128 |
| A | ASP130 |
| A | TYR134 |
| A | GLU169 |
| A | SO41003 |
| A | HOH1013 |
| A | HOH1127 |
| B | GLN94 |
| B | HOH1146 |
| B | HOH1171 |
| site_id | BC1 |
| Number of Residues | 9 |
| Details | BINDING SITE FOR RESIDUE GOL B 1002 |
| Chain | Residue |
| A | GLN94 |
| B | ASP130 |
| B | TYR134 |
| B | GLU169 |
| B | SO41004 |
| B | HOH1024 |
| B | HOH1114 |
| B | HOH1119 |
| B | HOH1149 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 12 |
| Details | ACT_SITE: ACT_SITE => ECO:0000255|PROSITE-ProRule:PRU01340 |
| Chain | Residue | Details |
| A | ARG128 | |
| D | ARG128 | |
| D | SER174 | |
| D | GLU213 | |
| A | SER174 | |
| A | GLU213 | |
| B | ARG128 | |
| B | SER174 | |
| B | GLU213 | |
| C | ARG128 | |
| C | SER174 | |
| C | GLU213 |
| site_id | SWS_FT_FI2 |
| Number of Residues | 28 |
| Details | BINDING: BINDING => ECO:0000250|UniProtKB:P15879 |
| Chain | Residue | Details |
| A | THR80 | |
| B | ARG91 | |
| B | ARG128 | |
| B | ARG167 | |
| B | PHE182 | |
| B | GLN211 | |
| C | THR80 | |
| C | ASN87 | |
| C | ARG91 | |
| C | ARG128 | |
| C | ARG167 | |
| A | ASN87 | |
| C | PHE182 | |
| C | GLN211 | |
| D | THR80 | |
| D | ASN87 | |
| D | ARG91 | |
| D | ARG128 | |
| D | ARG167 | |
| D | PHE182 | |
| D | GLN211 | |
| A | ARG91 | |
| A | ARG128 | |
| A | ARG167 | |
| A | PHE182 | |
| A | GLN211 | |
| B | THR80 | |
| B | ASN87 |
| site_id | SWS_FT_FI3 |
| Number of Residues | 4 |
| Details | SITE: Transition state stabilizer => ECO:0000250|UniProtKB:P15879 |
| Chain | Residue | Details |
| A | GLU213 | |
| B | GLU213 | |
| C | GLU213 | |
| D | GLU213 |
Catalytic Information from CSA
| site_id | CSA1 |
| Number of Residues | 1 |
| Details | Annotated By Reference To The Literature 1g24 |
| Chain | Residue | Details |
| A | GLU213 |
| site_id | CSA2 |
| Number of Residues | 1 |
| Details | Annotated By Reference To The Literature 1g24 |
| Chain | Residue | Details |
| B | GLU213 |
| site_id | CSA3 |
| Number of Residues | 1 |
| Details | Annotated By Reference To The Literature 1g24 |
| Chain | Residue | Details |
| C | GLU213 |
| site_id | CSA4 |
| Number of Residues | 1 |
| Details | Annotated By Reference To The Literature 1g24 |
| Chain | Residue | Details |
| D | GLU213 |
