4B2C
Structure of the factor Xa-like trypsin variant triple-Ala (TPA) in complex with eglin C
Functional Information from GO Data
Chain | GOid | namespace | contents |
A | 0004175 | molecular_function | endopeptidase activity |
A | 0004252 | molecular_function | serine-type endopeptidase activity |
A | 0005515 | molecular_function | protein binding |
A | 0005576 | cellular_component | extracellular region |
A | 0005615 | cellular_component | extracellular space |
A | 0006508 | biological_process | proteolysis |
A | 0007586 | biological_process | digestion |
A | 0008236 | molecular_function | serine-type peptidase activity |
A | 0046872 | molecular_function | metal ion binding |
A | 0097180 | cellular_component | serine protease inhibitor complex |
A | 0097655 | molecular_function | serpin family protein binding |
B | 0004867 | molecular_function | serine-type endopeptidase inhibitor activity |
B | 0009611 | biological_process | response to wounding |
B | 0010466 | biological_process | negative regulation of peptidase activity |
C | 0004175 | molecular_function | endopeptidase activity |
C | 0004252 | molecular_function | serine-type endopeptidase activity |
C | 0005515 | molecular_function | protein binding |
C | 0005576 | cellular_component | extracellular region |
C | 0005615 | cellular_component | extracellular space |
C | 0006508 | biological_process | proteolysis |
C | 0007586 | biological_process | digestion |
C | 0008236 | molecular_function | serine-type peptidase activity |
C | 0046872 | molecular_function | metal ion binding |
C | 0097180 | cellular_component | serine protease inhibitor complex |
C | 0097655 | molecular_function | serpin family protein binding |
D | 0004867 | molecular_function | serine-type endopeptidase inhibitor activity |
D | 0009611 | biological_process | response to wounding |
D | 0010466 | biological_process | negative regulation of peptidase activity |
Functional Information from PDB Data
site_id | AC1 |
Number of Residues | 6 |
Details | BINDING SITE FOR RESIDUE CA A 1246 |
Chain | Residue |
A | GLU70 |
A | ASN72 |
A | VAL75 |
A | GLU80 |
A | HOH2069 |
A | HOH2070 |
site_id | AC2 |
Number of Residues | 6 |
Details | BINDING SITE FOR RESIDUE CA C 1246 |
Chain | Residue |
C | GLU80 |
C | HOH2066 |
C | HOH2067 |
C | GLU70 |
C | ASN72 |
C | VAL75 |
site_id | AC3 |
Number of Residues | 2 |
Details | BINDING SITE FOR RESIDUE CL B 1071 |
Chain | Residue |
A | HOH2035 |
B | ASN50 |
site_id | AC4 |
Number of Residues | 3 |
Details | BINDING SITE FOR RESIDUE CL C 1247 |
Chain | Residue |
C | VAL75 |
C | VAL76 |
C | HOH2074 |
site_id | AC5 |
Number of Residues | 7 |
Details | BINDING SITE FOR RESIDUE GOL B 1072 |
Chain | Residue |
B | TYR35 |
B | LEU37 |
B | ARG51 |
B | ARG53 |
B | HOH2054 |
B | HOH2057 |
B | HOH2073 |
site_id | AC6 |
Number of Residues | 5 |
Details | BINDING SITE FOR RESIDUE GOL A 1247 |
Chain | Residue |
A | GLN135 |
A | CYS136 |
A | VAL200 |
A | SER202 |
A | GLY203 |
site_id | AC7 |
Number of Residues | 7 |
Details | BINDING SITE FOR RESIDUE GOL D 1071 |
Chain | Residue |
C | EDO1256 |
D | TYR35 |
D | ARG51 |
D | ARG53 |
D | HOH2042 |
D | HOH2046 |
D | HOH2056 |
site_id | AC8 |
Number of Residues | 7 |
Details | BINDING SITE FOR RESIDUE GOL A 1248 |
Chain | Residue |
A | THR144 |
A | SER150 |
A | PRO152 |
A | GOL1249 |
A | HOH2180 |
B | GLU2 |
B | GLY4 |
site_id | AC9 |
Number of Residues | 6 |
Details | BINDING SITE FOR RESIDUE GOL A 1249 |
Chain | Residue |
A | ILE16 |
A | GLY18 |
A | GLY19 |
A | LYS156 |
A | GOL1248 |
A | HOH2002 |
site_id | BC1 |
Number of Residues | 7 |
Details | BINDING SITE FOR RESIDUE GOL D 1072 |
Chain | Residue |
C | HOH2170 |
C | HOH2171 |
D | GLU39 |
D | GLY40 |
D | HIS65 |
D | HOH2057 |
D | HOH2058 |
site_id | BC2 |
Number of Residues | 8 |
Details | BINDING SITE FOR RESIDUE GOL B 1073 |
Chain | Residue |
A | HOH2171 |
A | HOH2173 |
B | GLU39 |
B | GLY40 |
B | PHE55 |
B | HIS65 |
B | HOH2075 |
B | HOH2077 |
site_id | BC3 |
Number of Residues | 5 |
Details | BINDING SITE FOR RESIDUE GOL C 1248 |
Chain | Residue |
C | GLN135 |
C | VAL200 |
C | CYS201 |
C | SER202 |
C | GLY203 |
site_id | BC4 |
Number of Residues | 6 |
Details | BINDING SITE FOR RESIDUE GOL A 1250 |
Chain | Residue |
A | TYR59 |
A | SER61 |
A | GLY62 |
A | ALA85 |
A | HOH2058 |
A | HOH2091 |
site_id | BC5 |
Number of Residues | 4 |
Details | BINDING SITE FOR RESIDUE GOL B 1074 |
Chain | Residue |
B | GLU12 |
B | TYR24 |
B | HIS28 |
B | TYR29 |
site_id | BC6 |
Number of Residues | 6 |
Details | BINDING SITE FOR RESIDUE GOL D 1073 |
Chain | Residue |
C | ASP153 |
C | GOL1251 |
D | THR1 |
D | PHE3 |
D | GLY4 |
D | SER5 |
site_id | BC7 |
Number of Residues | 3 |
Details | BINDING SITE FOR RESIDUE GOL C 1249 |
Chain | Residue |
C | TYR20 |
C | CYS22 |
C | THR26 |
site_id | BC8 |
Number of Residues | 5 |
Details | BINDING SITE FOR RESIDUE GOL B 1075 |
Chain | Residue |
A | ASP153 |
B | THR1 |
B | PHE3 |
B | GLY4 |
B | SER5 |
site_id | BC9 |
Number of Residues | 6 |
Details | BINDING SITE FOR RESIDUE GOL C 1250 |
Chain | Residue |
C | HIS91 |
C | ASN101 |
C | ASN179 |
C | ASN233 |
C | TYR234 |
C | HOH2152 |
site_id | CC1 |
Number of Residues | 5 |
Details | BINDING SITE FOR RESIDUE GOL B 1076 |
Chain | Residue |
B | GLU6 |
B | LEU7 |
B | LYS8 |
B | HOH2010 |
B | HOH2078 |
site_id | CC2 |
Number of Residues | 3 |
Details | BINDING SITE FOR RESIDUE GOL C 1251 |
Chain | Residue |
C | ASN74 |
D | SER5 |
D | GOL1073 |
site_id | CC3 |
Number of Residues | 8 |
Details | BINDING SITE FOR RESIDUE GOL A 1251 |
Chain | Residue |
A | ASN34 |
A | GLY38 |
A | TYR39 |
A | HIS40 |
A | ARG66 |
A | ILE73 |
A | ASN74 |
A | HOH2076 |
site_id | CC4 |
Number of Residues | 8 |
Details | BINDING SITE FOR RESIDUE GOL C 1252 |
Chain | Residue |
C | ASN34 |
C | GLY38 |
C | TYR39 |
C | HIS40 |
C | ARG66 |
C | ILE73 |
C | ASN74 |
C | HOH2075 |
site_id | CC5 |
Number of Residues | 7 |
Details | BINDING SITE FOR RESIDUE GOL B 1077 |
Chain | Residue |
A | THR149 |
A | TYR151 |
A | HOH2166 |
B | VAL69 |
B | GLY70 |
B | HOH2059 |
B | HOH2060 |
site_id | CC6 |
Number of Residues | 6 |
Details | BINDING SITE FOR RESIDUE GOL C 1253 |
Chain | Residue |
C | ILE16 |
C | GLY18 |
C | GLY19 |
C | LYS156 |
C | HOH2002 |
D | GLU2 |
site_id | CC7 |
Number of Residues | 3 |
Details | BINDING SITE FOR RESIDUE EDO C 1254 |
Chain | Residue |
C | ALA129 |
C | PHE181 |
C | HOH2128 |
site_id | CC8 |
Number of Residues | 1 |
Details | BINDING SITE FOR RESIDUE EDO B 1078 |
Chain | Residue |
B | HOH2079 |
site_id | CC9 |
Number of Residues | 4 |
Details | BINDING SITE FOR RESIDUE EDO C 1255 |
Chain | Residue |
C | GLN50 |
C | TRP51 |
C | ILE242 |
C | ASN245 |
site_id | DC1 |
Number of Residues | 4 |
Details | BINDING SITE FOR RESIDUE EDO C 1256 |
Chain | Residue |
C | SER96 |
C | LYS159 |
C | HOH2146 |
D | GOL1071 |
Functional Information from PROSITE/UniProt
Functional Information from SwissProt/UniProt
site_id | SWS_FT_FI1 |
Number of Residues | 2 |
Details | SITE: Reactive bond |
Chain | Residue | Details |
B | LYS45 | |
D | LYS45 | |
A | ALA195 | |
C | HIS57 | |
C | ASP102 | |
C | ALA195 |
site_id | SWS_FT_FI2 |
Number of Residues | 14 |
Details | BINDING: |
Chain | Residue | Details |
A | GLU70 | |
C | VAL75 | |
C | GLU80 | |
C | ASP189 | |
C | GLN192 | |
C | ALA195 | |
A | ASN72 | |
A | VAL75 | |
A | GLU80 | |
A | ASP189 | |
A | GLN192 | |
A | ALA195 | |
C | GLU70 | |
C | ASN72 |