6T13
CRYSTAL STRUCTURE OF GLUCOCEREBROSIDASE IN COMPLEX WITH A PYRROLOPYRAZINE
Functional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0004348 | molecular_function | glucosylceramidase activity |
| A | 0006665 | biological_process | sphingolipid metabolic process |
| B | 0004348 | molecular_function | glucosylceramidase activity |
| B | 0006665 | biological_process | sphingolipid metabolic process |
| C | 0004348 | molecular_function | glucosylceramidase activity |
| C | 0006665 | biological_process | sphingolipid metabolic process |
| D | 0004348 | molecular_function | glucosylceramidase activity |
| D | 0006665 | biological_process | sphingolipid metabolic process |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 4 |
| Details | ACT_SITE: Proton donor => ECO:0000269|PubMed:15817452 |
| Chain | Residue | Details |
| A | GLU235 | |
| B | GLU235 | |
| C | GLU235 | |
| D | GLU235 |
| site_id | SWS_FT_FI2 |
| Number of Residues | 4 |
| Details | ACT_SITE: Nucleophile => ECO:0000269|PubMed:15817452 |
| Chain | Residue | Details |
| A | GLU340 | |
| B | GLU340 | |
| C | GLU340 | |
| D | GLU340 |
| site_id | SWS_FT_FI3 |
| Number of Residues | 4 |
| Details | CARBOHYD: N-linked (GlcNAc...) asparagine => ECO:0000269|PubMed:12792654, ECO:0000269|PubMed:17139081 |
| Chain | Residue | Details |
| A | ASN19 | |
| B | ASN19 | |
| C | ASN19 | |
| D | ASN19 |
| site_id | SWS_FT_FI4 |
| Number of Residues | 4 |
| Details | CARBOHYD: N-linked (GlcNAc...) asparagine => ECO:0000269|PubMed:12754519, ECO:0000269|PubMed:17139081, ECO:0000269|PubMed:19159218 |
| Chain | Residue | Details |
| A | ASN59 | |
| B | ASN59 | |
| C | ASN59 | |
| D | ASN59 |
| site_id | SWS_FT_FI5 |
| Number of Residues | 4 |
| Details | CARBOHYD: N-linked (GlcNAc...) asparagine => ECO:0000269|PubMed:12754519, ECO:0000269|PubMed:17139081 |
| Chain | Residue | Details |
| A | ASN146 | |
| B | ASN146 | |
| C | ASN146 | |
| D | ASN146 |
| site_id | SWS_FT_FI6 |
| Number of Residues | 4 |
| Details | CARBOHYD: N-linked (GlcNAc...) asparagine => ECO:0000269|PubMed:12754519, ECO:0000269|PubMed:19159218 |
| Chain | Residue | Details |
| A | ASN270 | |
| B | ASN270 | |
| C | ASN270 | |
| D | ASN270 |
| site_id | SWS_FT_FI7 |
| Number of Residues | 4 |
| Details | CARBOHYD: N-linked (GlcNAc...) asparagine => ECO:0000255 |
| Chain | Residue | Details |
| A | ASN462 | |
| B | ASN462 | |
| C | ASN462 | |
| D | ASN462 |
Catalytic Information from CSA
| site_id | MCSA1 |
| Number of Residues | 4 |
| Details | M-CSA 764 |
| Chain | Residue | Details |
| A | GLU235 | activator, increase nucleophilicity, promote heterolysis, proton acceptor, proton donor |
| A | GLU340 | covalently attached, nucleofuge, nucleophile |
| A | CYS342 | electrostatic stabiliser |
| A | ASN370 |
| site_id | MCSA2 |
| Number of Residues | 4 |
| Details | M-CSA 764 |
| Chain | Residue | Details |
| B | GLU235 | activator, increase nucleophilicity, promote heterolysis, proton acceptor, proton donor |
| B | GLU340 | covalently attached, nucleofuge, nucleophile |
| B | CYS342 | electrostatic stabiliser |
| B | ASN370 |
| site_id | MCSA3 |
| Number of Residues | 4 |
| Details | M-CSA 764 |
| Chain | Residue | Details |
| C | GLU235 | activator, increase nucleophilicity, promote heterolysis, proton acceptor, proton donor |
| C | GLU340 | covalently attached, nucleofuge, nucleophile |
| C | CYS342 | electrostatic stabiliser |
| C | ASN370 |
| site_id | MCSA4 |
| Number of Residues | 4 |
| Details | M-CSA 764 |
| Chain | Residue | Details |
| D | GLU235 | activator, increase nucleophilicity, promote heterolysis, proton acceptor, proton donor |
| D | GLU340 | covalently attached, nucleofuge, nucleophile |
| D | CYS342 | electrostatic stabiliser |
| D | ASN370 |
