2OZR
MMP13 Catalytic Domain Complexed with 4-{[1-methyl-2,4-dioxo-6-(3-phenylprop-1-yn-1-yl)-1,4-dihydroquinazolin-3(2H)-yl]methyl}benzoic acid
Functional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0004222 | molecular_function | metalloendopeptidase activity |
| A | 0006508 | biological_process | proteolysis |
| A | 0008237 | molecular_function | metallopeptidase activity |
| A | 0008270 | molecular_function | zinc ion binding |
| A | 0031012 | cellular_component | extracellular matrix |
| B | 0004222 | molecular_function | metalloendopeptidase activity |
| B | 0006508 | biological_process | proteolysis |
| B | 0008237 | molecular_function | metallopeptidase activity |
| B | 0008270 | molecular_function | zinc ion binding |
| B | 0031012 | cellular_component | extracellular matrix |
| C | 0004222 | molecular_function | metalloendopeptidase activity |
| C | 0006508 | biological_process | proteolysis |
| C | 0008237 | molecular_function | metallopeptidase activity |
| C | 0008270 | molecular_function | zinc ion binding |
| C | 0031012 | cellular_component | extracellular matrix |
| D | 0004222 | molecular_function | metalloendopeptidase activity |
| D | 0006508 | biological_process | proteolysis |
| D | 0008237 | molecular_function | metallopeptidase activity |
| D | 0008270 | molecular_function | zinc ion binding |
| D | 0031012 | cellular_component | extracellular matrix |
| E | 0004222 | molecular_function | metalloendopeptidase activity |
| E | 0006508 | biological_process | proteolysis |
| E | 0008237 | molecular_function | metallopeptidase activity |
| E | 0008270 | molecular_function | zinc ion binding |
| E | 0031012 | cellular_component | extracellular matrix |
| F | 0004222 | molecular_function | metalloendopeptidase activity |
| F | 0006508 | biological_process | proteolysis |
| F | 0008237 | molecular_function | metallopeptidase activity |
| F | 0008270 | molecular_function | zinc ion binding |
| F | 0031012 | cellular_component | extracellular matrix |
| G | 0004222 | molecular_function | metalloendopeptidase activity |
| G | 0006508 | biological_process | proteolysis |
| G | 0008237 | molecular_function | metallopeptidase activity |
| G | 0008270 | molecular_function | zinc ion binding |
| G | 0031012 | cellular_component | extracellular matrix |
| H | 0004222 | molecular_function | metalloendopeptidase activity |
| H | 0006508 | biological_process | proteolysis |
| H | 0008237 | molecular_function | metallopeptidase activity |
| H | 0008270 | molecular_function | zinc ion binding |
| H | 0031012 | cellular_component | extracellular matrix |
Functional Information from PROSITE/UniProt
| site_id | PS00142 |
| Number of Residues | 10 |
| Details | ZINC_PROTEASE Neutral zinc metallopeptidases, zinc-binding region signature. VAAHEFGHSL |
| Chain | Residue | Details |
| A | VAL198-LEU207 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 8 |
| Details | ACT_SITE: ACT_SITE => ECO:0000305|PubMed:23913860 |
| Chain | Residue | Details |
| A | GLU202 | |
| B | GLU202 | |
| C | GLU202 | |
| D | GLU202 | |
| E | GLU202 | |
| F | GLU202 | |
| G | GLU202 | |
| H | GLU202 |
| site_id | SWS_FT_FI2 |
| Number of Residues | 96 |
| Details | BINDING: BINDING => ECO:0000269|PubMed:10926524, ECO:0000269|PubMed:10986126, ECO:0000269|PubMed:15734645, ECO:0000269|PubMed:15780611, ECO:0000269|PubMed:17196980, ECO:0000269|PubMed:17623656, ECO:0000269|PubMed:19422229, ECO:0000269|PubMed:20005097, ECO:0000269|PubMed:20726512, ECO:0000269|PubMed:22689580, ECO:0000269|PubMed:23810497, ECO:0000269|PubMed:23913860, ECO:0000269|PubMed:8969305 |
| Chain | Residue | Details |
| A | ASP107 | |
| A | ASP181 | |
| A | ASP182 | |
| A | GLU184 | |
| B | ASP107 | |
| B | ASP141 | |
| B | ASP158 | |
| B | GLY159 | |
| B | SER161 | |
| B | LEU163 | |
| B | ASN173 | |
| A | ASP141 | |
| B | GLY175 | |
| B | ASP177 | |
| B | ASP181 | |
| B | ASP182 | |
| B | GLU184 | |
| C | ASP107 | |
| C | ASP141 | |
| C | ASP158 | |
| C | GLY159 | |
| C | SER161 | |
| A | ASP158 | |
| C | LEU163 | |
| C | ASN173 | |
| C | GLY175 | |
| C | ASP177 | |
| C | ASP181 | |
| C | ASP182 | |
| C | GLU184 | |
| D | ASP107 | |
| D | ASP141 | |
| D | ASP158 | |
| A | GLY159 | |
| D | GLY159 | |
| D | SER161 | |
| D | LEU163 | |
| D | ASN173 | |
| D | GLY175 | |
| D | ASP177 | |
| D | ASP181 | |
| D | ASP182 | |
| D | GLU184 | |
| E | ASP107 | |
| A | SER161 | |
| E | ASP141 | |
| E | ASP158 | |
| E | GLY159 | |
| E | SER161 | |
| E | LEU163 | |
| E | ASN173 | |
| E | GLY175 | |
| E | ASP177 | |
| E | ASP181 | |
| E | ASP182 | |
| A | LEU163 | |
| E | GLU184 | |
| F | ASP107 | |
| F | ASP141 | |
| F | ASP158 | |
| F | GLY159 | |
| F | SER161 | |
| F | LEU163 | |
| F | ASN173 | |
| F | GLY175 | |
| F | ASP177 | |
| A | ASN173 | |
| F | ASP181 | |
| F | ASP182 | |
| F | GLU184 | |
| G | ASP107 | |
| G | ASP141 | |
| G | ASP158 | |
| G | GLY159 | |
| G | SER161 | |
| G | LEU163 | |
| G | ASN173 | |
| A | GLY175 | |
| G | GLY175 | |
| G | ASP177 | |
| G | ASP181 | |
| G | ASP182 | |
| G | GLU184 | |
| H | ASP107 | |
| H | ASP141 | |
| H | ASP158 | |
| H | GLY159 | |
| H | SER161 | |
| A | ASP177 | |
| H | LEU163 | |
| H | ASN173 | |
| H | GLY175 | |
| H | ASP177 | |
| H | ASP181 | |
| H | ASP182 | |
| H | GLU184 |
| site_id | SWS_FT_FI3 |
| Number of Residues | 64 |
| Details | BINDING: BINDING => ECO:0000269|PubMed:10926524, ECO:0000269|PubMed:10986126, ECO:0000269|PubMed:15734645, ECO:0000269|PubMed:15780611, ECO:0000269|PubMed:17196980, ECO:0000269|PubMed:17623656, ECO:0000269|PubMed:19422229, ECO:0000269|PubMed:20005097, ECO:0000269|PubMed:20726512, ECO:0000269|PubMed:22689580, ECO:0000269|PubMed:23810497, ECO:0000269|PubMed:23913860 |
| Chain | Residue | Details |
| A | HIS151 | |
| B | ASP153 | |
| B | HIS166 | |
| B | HIS179 | |
| B | HIS201 | |
| B | HIS205 | |
| B | HIS211 | |
| B | MET219 | |
| C | HIS151 | |
| C | ASP153 | |
| C | HIS166 | |
| A | ASP153 | |
| C | HIS179 | |
| C | HIS201 | |
| C | HIS205 | |
| C | HIS211 | |
| C | MET219 | |
| D | HIS151 | |
| D | ASP153 | |
| D | HIS166 | |
| D | HIS179 | |
| D | HIS201 | |
| A | HIS166 | |
| D | HIS205 | |
| D | HIS211 | |
| D | MET219 | |
| E | HIS151 | |
| E | ASP153 | |
| E | HIS166 | |
| E | HIS179 | |
| E | HIS201 | |
| E | HIS205 | |
| E | HIS211 | |
| A | HIS179 | |
| E | MET219 | |
| F | HIS151 | |
| F | ASP153 | |
| F | HIS166 | |
| F | HIS179 | |
| F | HIS201 | |
| F | HIS205 | |
| F | HIS211 | |
| F | MET219 | |
| G | HIS151 | |
| A | HIS201 | |
| G | ASP153 | |
| G | HIS166 | |
| G | HIS179 | |
| G | HIS201 | |
| G | HIS205 | |
| G | HIS211 | |
| G | MET219 | |
| H | HIS151 | |
| H | ASP153 | |
| H | HIS166 | |
| A | HIS205 | |
| H | HIS179 | |
| H | HIS201 | |
| H | HIS205 | |
| H | HIS211 | |
| H | MET219 | |
| A | HIS211 | |
| A | MET219 | |
| B | HIS151 |
| site_id | SWS_FT_FI4 |
| Number of Residues | 8 |
| Details | CARBOHYD: N-linked (GlcNAc...) asparagine => ECO:0000269|PubMed:8576151 |
| Chain | Residue | Details |
| A | ASN96 | |
| B | ASN96 | |
| C | ASN96 | |
| D | ASN96 | |
| E | ASN96 | |
| F | ASN96 | |
| G | ASN96 | |
| H | ASN96 |
| site_id | SWS_FT_FI5 |
| Number of Residues | 8 |
| Details | CARBOHYD: N-linked (GlcNAc...) asparagine => ECO:0000255 |
| Chain | Residue | Details |
| A | ASN131 | |
| B | ASN131 | |
| C | ASN131 | |
| D | ASN131 | |
| E | ASN131 | |
| F | ASN131 | |
| G | ASN131 | |
| H | ASN131 |
Catalytic Information from CSA
| site_id | CSA1 |
| Number of Residues | 2 |
| Details | Annotated By Reference To The Literature 1hfs |
| Chain | Residue | Details |
| A | MET219 | |
| A | GLU202 |
| site_id | CSA10 |
| Number of Residues | 1 |
| Details | Annotated By Reference To The Literature 1hfs |
| Chain | Residue | Details |
| B | GLU202 |
| site_id | CSA11 |
| Number of Residues | 1 |
| Details | Annotated By Reference To The Literature 1hfs |
| Chain | Residue | Details |
| C | GLU202 |
| site_id | CSA12 |
| Number of Residues | 1 |
| Details | Annotated By Reference To The Literature 1hfs |
| Chain | Residue | Details |
| D | GLU202 |
| site_id | CSA13 |
| Number of Residues | 1 |
| Details | Annotated By Reference To The Literature 1hfs |
| Chain | Residue | Details |
| E | GLU202 |
| site_id | CSA14 |
| Number of Residues | 1 |
| Details | Annotated By Reference To The Literature 1hfs |
| Chain | Residue | Details |
| F | GLU202 |
| site_id | CSA15 |
| Number of Residues | 1 |
| Details | Annotated By Reference To The Literature 1hfs |
| Chain | Residue | Details |
| G | GLU202 |
| site_id | CSA16 |
| Number of Residues | 1 |
| Details | Annotated By Reference To The Literature 1hfs |
| Chain | Residue | Details |
| H | GLU202 |
| site_id | CSA2 |
| Number of Residues | 2 |
| Details | Annotated By Reference To The Literature 1hfs |
| Chain | Residue | Details |
| B | MET219 | |
| B | GLU202 |
| site_id | CSA3 |
| Number of Residues | 2 |
| Details | Annotated By Reference To The Literature 1hfs |
| Chain | Residue | Details |
| C | MET219 | |
| C | GLU202 |
| site_id | CSA4 |
| Number of Residues | 2 |
| Details | Annotated By Reference To The Literature 1hfs |
| Chain | Residue | Details |
| D | MET219 | |
| D | GLU202 |
| site_id | CSA5 |
| Number of Residues | 2 |
| Details | Annotated By Reference To The Literature 1hfs |
| Chain | Residue | Details |
| E | MET219 | |
| E | GLU202 |
| site_id | CSA6 |
| Number of Residues | 2 |
| Details | Annotated By Reference To The Literature 1hfs |
| Chain | Residue | Details |
| F | MET219 | |
| F | GLU202 |
| site_id | CSA7 |
| Number of Residues | 2 |
| Details | Annotated By Reference To The Literature 1hfs |
| Chain | Residue | Details |
| G | MET219 | |
| G | GLU202 |
| site_id | CSA8 |
| Number of Residues | 2 |
| Details | Annotated By Reference To The Literature 1hfs |
| Chain | Residue | Details |
| H | MET219 | |
| H | GLU202 |
| site_id | CSA9 |
| Number of Residues | 1 |
| Details | Annotated By Reference To The Literature 1hfs |
| Chain | Residue | Details |
| A | GLU202 |
