4A22
Structure of Mycobacterium tuberculosis fructose 1,6-bisphosphate aldolase bound to N-(4-hydroxybutyl)- glycolohydroxamic acid bis- phosphate
Functional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0004332 | molecular_function | fructose-bisphosphate aldolase activity |
| A | 0005576 | cellular_component | extracellular region |
| A | 0005829 | cellular_component | cytosol |
| A | 0005886 | cellular_component | plasma membrane |
| A | 0005975 | biological_process | carbohydrate metabolic process |
| A | 0006096 | biological_process | glycolytic process |
| A | 0008270 | molecular_function | zinc ion binding |
| A | 0009274 | cellular_component | peptidoglycan-based cell wall |
| A | 0016829 | molecular_function | lyase activity |
| A | 0016832 | molecular_function | aldehyde-lyase activity |
| A | 0035375 | molecular_function | zymogen binding |
| A | 0046872 | molecular_function | metal ion binding |
| B | 0004332 | molecular_function | fructose-bisphosphate aldolase activity |
| B | 0005576 | cellular_component | extracellular region |
| B | 0005829 | cellular_component | cytosol |
| B | 0005886 | cellular_component | plasma membrane |
| B | 0005975 | biological_process | carbohydrate metabolic process |
| B | 0006096 | biological_process | glycolytic process |
| B | 0008270 | molecular_function | zinc ion binding |
| B | 0009274 | cellular_component | peptidoglycan-based cell wall |
| B | 0016829 | molecular_function | lyase activity |
| B | 0016832 | molecular_function | aldehyde-lyase activity |
| B | 0035375 | molecular_function | zymogen binding |
| B | 0046872 | molecular_function | metal ion binding |
| C | 0004332 | molecular_function | fructose-bisphosphate aldolase activity |
| C | 0005576 | cellular_component | extracellular region |
| C | 0005829 | cellular_component | cytosol |
| C | 0005886 | cellular_component | plasma membrane |
| C | 0005975 | biological_process | carbohydrate metabolic process |
| C | 0006096 | biological_process | glycolytic process |
| C | 0008270 | molecular_function | zinc ion binding |
| C | 0009274 | cellular_component | peptidoglycan-based cell wall |
| C | 0016829 | molecular_function | lyase activity |
| C | 0016832 | molecular_function | aldehyde-lyase activity |
| C | 0035375 | molecular_function | zymogen binding |
| C | 0046872 | molecular_function | metal ion binding |
| D | 0004332 | molecular_function | fructose-bisphosphate aldolase activity |
| D | 0005576 | cellular_component | extracellular region |
| D | 0005829 | cellular_component | cytosol |
| D | 0005886 | cellular_component | plasma membrane |
| D | 0005975 | biological_process | carbohydrate metabolic process |
| D | 0006096 | biological_process | glycolytic process |
| D | 0008270 | molecular_function | zinc ion binding |
| D | 0009274 | cellular_component | peptidoglycan-based cell wall |
| D | 0016829 | molecular_function | lyase activity |
| D | 0016832 | molecular_function | aldehyde-lyase activity |
| D | 0035375 | molecular_function | zymogen binding |
| D | 0046872 | molecular_function | metal ion binding |
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 24 |
| Details | BINDING SITE FOR RESIDUE TD4 A 1344 |
| Chain | Residue |
| A | ASN27 |
| A | ASN274 |
| A | VAL275 |
| A | ASP276 |
| A | THR277 |
| A | NA1345 |
| A | ZN1348 |
| A | SO41349 |
| A | SO41350 |
| A | HOH2065 |
| A | HOH2069 |
| A | SER53 |
| A | HOH2201 |
| A | HOH2277 |
| A | HOH2278 |
| A | HOH2279 |
| B | ARG314 |
| A | ASP95 |
| A | HIS96 |
| A | HIS212 |
| A | GLY213 |
| A | HIS252 |
| A | GLY253 |
| A | SER255 |
| site_id | AC2 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE NA A 1345 |
| Chain | Residue |
| A | VAL211 |
| A | GLY213 |
| A | GLY253 |
| A | SER255 |
| A | TD41344 |
| A | SO41349 |
| site_id | AC3 |
| Number of Residues | 8 |
| Details | BINDING SITE FOR RESIDUE NA A 1346 |
| Chain | Residue |
| A | GLN51 |
| A | HIS93 |
| A | ASP95 |
| A | MET129 |
| A | GLU159 |
| A | HIS252 |
| A | LYS272 |
| A | ASN274 |
| site_id | AC4 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE NA A 1347 |
| Chain | Residue |
| A | THR94 |
| A | ASP95 |
| A | CYS97 |
| A | VAL106 |
| A | MET129 |
| site_id | AC5 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE ZN A 1348 |
| Chain | Residue |
| A | HIS96 |
| A | HIS212 |
| A | HIS252 |
| A | TD41344 |
| site_id | AC6 |
| Number of Residues | 10 |
| Details | BINDING SITE FOR RESIDUE SO4 A 1349 |
| Chain | Residue |
| A | HIS212 |
| A | GLY213 |
| A | GLY253 |
| A | GLY254 |
| A | SER255 |
| A | ASP276 |
| A | THR277 |
| A | TD41344 |
| A | NA1345 |
| A | HOH2279 |
| site_id | AC7 |
| Number of Residues | 8 |
| Details | BINDING SITE FOR RESIDUE SO4 A 1350 |
| Chain | Residue |
| A | SER53 |
| A | TD41344 |
| A | HOH2065 |
| A | HOH2069 |
| A | HOH2201 |
| A | HOH2277 |
| A | HOH2278 |
| B | ARG314 |
| site_id | AC8 |
| Number of Residues | 22 |
| Details | BINDING SITE FOR RESIDUE TD4 B 1344 |
| Chain | Residue |
| A | ARG314 |
| A | HOH2242 |
| B | ASN27 |
| B | SER53 |
| B | GLY55 |
| B | ASP95 |
| B | HIS96 |
| B | HIS212 |
| B | GLY213 |
| B | HIS252 |
| B | GLY253 |
| B | SER255 |
| B | ASN274 |
| B | VAL275 |
| B | ASP276 |
| B | THR277 |
| B | ZN1345 |
| B | SO41346 |
| B | SO41347 |
| B | NA1348 |
| B | HOH2252 |
| B | HOH2253 |
| site_id | AC9 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE ZN B 1345 |
| Chain | Residue |
| B | HIS96 |
| B | HIS212 |
| B | HIS252 |
| B | ASN274 |
| B | TD41344 |
| site_id | BC1 |
| Number of Residues | 11 |
| Details | BINDING SITE FOR RESIDUE SO4 B 1346 |
| Chain | Residue |
| B | ASP276 |
| B | THR277 |
| B | TD41344 |
| B | NA1348 |
| A | HOH2242 |
| B | HIS212 |
| B | GLY213 |
| B | GLY253 |
| B | GLY254 |
| B | SER255 |
| B | ASN274 |
| site_id | BC2 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE SO4 B 1347 |
| Chain | Residue |
| A | ARG314 |
| B | SER53 |
| B | GLY55 |
| B | TD41344 |
| B | HOH2252 |
| B | HOH2253 |
| site_id | BC3 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE NA B 1348 |
| Chain | Residue |
| B | VAL211 |
| B | GLY213 |
| B | GLY253 |
| B | SER255 |
| B | TD41344 |
| B | SO41346 |
| site_id | BC4 |
| Number of Residues | 9 |
| Details | BINDING SITE FOR RESIDUE SO4 C 1344 |
| Chain | Residue |
| C | HIS212 |
| C | GLY213 |
| C | GLY253 |
| C | GLY254 |
| C | SER255 |
| C | ASP276 |
| C | THR277 |
| C | NA1346 |
| C | HOH2156 |
| site_id | BC5 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE SO4 C 1345 |
| Chain | Residue |
| C | SER53 |
| C | HOH2060 |
| C | HOH2218 |
| D | ARG314 |
| site_id | BC6 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE NA C 1346 |
| Chain | Residue |
| C | VAL211 |
| C | GLY213 |
| C | GLY253 |
| C | SER255 |
| C | SO41344 |
| site_id | BC7 |
| Number of Residues | 10 |
| Details | BINDING SITE FOR RESIDUE SO4 D 1344 |
| Chain | Residue |
| D | GLY213 |
| D | GLY254 |
| D | SER255 |
| D | ASN274 |
| D | ASP276 |
| D | THR277 |
| D | NA1346 |
| D | HOH2034 |
| D | HOH2197 |
| D | HOH2198 |
| site_id | BC8 |
| Number of Residues | 8 |
| Details | BINDING SITE FOR RESIDUE SO4 D 1345 |
| Chain | Residue |
| C | ARG314 |
| D | SER53 |
| D | THR54 |
| D | GLY55 |
| D | HOH2229 |
| D | HOH2291 |
| D | HOH2292 |
| D | HOH2293 |
| site_id | BC9 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE NA D 1346 |
| Chain | Residue |
| D | VAL211 |
| D | HIS212 |
| D | GLY213 |
| D | GLY253 |
| D | SER255 |
| D | SO41344 |
Functional Information from PROSITE/UniProt
| site_id | PS00602 |
| Number of Residues | 12 |
| Details | ALDOLASE_CLASS_II_1 Fructose-bisphosphate aldolase class-II signature 1. Yp..VNVa.LHtDHC |
| Chain | Residue | Details |
| A | TYR86-CYS97 |
| site_id | PS00806 |
| Number of Residues | 12 |
| Details | ALDOLASE_CLASS_II_2 Fructose-bisphosphate aldolase class-II signature 2. LEiEIGvvGGeE |
| Chain | Residue | Details |
| A | LEU158-GLU169 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 4 |
| Details | ACT_SITE: Proton donor => ECO:0000250 |
| Chain | Residue | Details |
| A | ASP95 | |
| B | ASP95 | |
| C | ASP95 | |
| D | ASP95 |
| site_id | SWS_FT_FI2 |
| Number of Residues | 36 |
| Details | BINDING: BINDING => ECO:0000250 |
| Chain | Residue | Details |
| A | SER53 | |
| B | SER53 | |
| B | HIS96 | |
| B | ASP131 | |
| B | GLU161 | |
| B | HIS212 | |
| B | GLY213 | |
| B | HIS252 | |
| B | GLY253 | |
| B | ASN274 | |
| C | SER53 | |
| A | HIS96 | |
| C | HIS96 | |
| C | ASP131 | |
| C | GLU161 | |
| C | HIS212 | |
| C | GLY213 | |
| C | HIS252 | |
| C | GLY253 | |
| C | ASN274 | |
| D | SER53 | |
| D | HIS96 | |
| A | ASP131 | |
| D | ASP131 | |
| D | GLU161 | |
| D | HIS212 | |
| D | GLY213 | |
| D | HIS252 | |
| D | GLY253 | |
| D | ASN274 | |
| A | GLU161 | |
| A | HIS212 | |
| A | GLY213 | |
| A | HIS252 | |
| A | GLY253 | |
| A | ASN274 |
