4U4M
Crystal structure of 0.5M urea unfolded YagE, a KDG aldolase protein in complex with Pyruvate
Functional Information from GO Data
Chain | GOid | namespace | contents |
A | 0005737 | cellular_component | cytoplasm |
A | 0005829 | cellular_component | cytosol |
A | 0016829 | molecular_function | lyase activity |
A | 0042802 | molecular_function | identical protein binding |
A | 0046176 | biological_process | aldonic acid catabolic process |
A | 0047440 | molecular_function | 2-dehydro-3-deoxy-D-pentonate aldolase activity |
A | 0061677 | molecular_function | 2-dehydro-3-deoxy-D-gluconate aldolase activity |
B | 0005737 | cellular_component | cytoplasm |
B | 0005829 | cellular_component | cytosol |
B | 0016829 | molecular_function | lyase activity |
B | 0042802 | molecular_function | identical protein binding |
B | 0046176 | biological_process | aldonic acid catabolic process |
B | 0047440 | molecular_function | 2-dehydro-3-deoxy-D-pentonate aldolase activity |
B | 0061677 | molecular_function | 2-dehydro-3-deoxy-D-gluconate aldolase activity |
C | 0005737 | cellular_component | cytoplasm |
C | 0005829 | cellular_component | cytosol |
C | 0016829 | molecular_function | lyase activity |
C | 0042802 | molecular_function | identical protein binding |
C | 0046176 | biological_process | aldonic acid catabolic process |
C | 0047440 | molecular_function | 2-dehydro-3-deoxy-D-pentonate aldolase activity |
C | 0061677 | molecular_function | 2-dehydro-3-deoxy-D-gluconate aldolase activity |
D | 0005737 | cellular_component | cytoplasm |
D | 0005829 | cellular_component | cytosol |
D | 0016829 | molecular_function | lyase activity |
D | 0042802 | molecular_function | identical protein binding |
D | 0046176 | biological_process | aldonic acid catabolic process |
D | 0047440 | molecular_function | 2-dehydro-3-deoxy-D-pentonate aldolase activity |
D | 0061677 | molecular_function | 2-dehydro-3-deoxy-D-gluconate aldolase activity |
Functional Information from PDB Data
site_id | AC1 |
Number of Residues | 4 |
Details | binding site for residue URE A 401 |
Chain | Residue |
A | PHE147 |
A | THR176 |
A | PHE265 |
A | PYR404 |
site_id | AC2 |
Number of Residues | 6 |
Details | binding site for residue URE A 402 |
Chain | Residue |
C | ARG184 |
A | ASP178 |
A | TYR203 |
A | ASP205 |
A | PRO256 |
C | ALA181 |
site_id | AC3 |
Number of Residues | 5 |
Details | binding site for residue URE A 403 |
Chain | Residue |
A | ASN93 |
A | ARG95 |
A | GLU96 |
A | GLU99 |
B | GLU67 |
site_id | AC4 |
Number of Residues | 9 |
Details | binding site for residue PYR A 404 |
Chain | Residue |
A | PRO20 |
A | PHE52 |
A | GLY55 |
A | SER56 |
A | GLY57 |
A | TYR145 |
A | LYS174 |
A | ILE219 |
A | URE401 |
site_id | AC5 |
Number of Residues | 6 |
Details | binding site for residue EDO A 407 |
Chain | Residue |
A | LEU54 |
A | PHE60 |
A | GLY90 |
A | VAL113 |
A | ILE115 |
A | TYR145 |
site_id | AC6 |
Number of Residues | 1 |
Details | binding site for residue EDO A 408 |
Chain | Residue |
A | ALA107 |
site_id | AC7 |
Number of Residues | 5 |
Details | binding site for residue URE B 401 |
Chain | Residue |
B | GLY202 |
B | TYR203 |
B | ALA221 |
B | PHE265 |
B | PYR405 |
site_id | AC8 |
Number of Residues | 3 |
Details | binding site for residue URE B 402 |
Chain | Residue |
B | ARG73 |
B | ASP77 |
C | GLU293 |
site_id | AC9 |
Number of Residues | 2 |
Details | binding site for residue URE B 403 |
Chain | Residue |
B | LEU31 |
B | GLU67 |
site_id | AD1 |
Number of Residues | 4 |
Details | binding site for residue URE B 404 |
Chain | Residue |
A | ARG129 |
B | ASP262 |
B | SER289 |
B | PRO290 |
site_id | AD2 |
Number of Residues | 7 |
Details | binding site for residue EDO B 406 |
Chain | Residue |
B | LEU54 |
B | PHE60 |
B | GLY88 |
B | GLY90 |
B | VAL113 |
B | VAL114 |
B | ILE115 |
site_id | AD3 |
Number of Residues | 1 |
Details | binding site for residue EDO B 407 |
Chain | Residue |
B | HIS283 |
site_id | AD4 |
Number of Residues | 2 |
Details | binding site for residue EDO B 408 |
Chain | Residue |
B | LYS191 |
B | PRO195 |
site_id | AD5 |
Number of Residues | 3 |
Details | binding site for residue URE C 401 |
Chain | Residue |
B | ASP77 |
C | GLU271 |
C | LYS296 |
site_id | AD6 |
Number of Residues | 6 |
Details | binding site for residue URE D 401 |
Chain | Residue |
D | PHE147 |
D | THR176 |
D | GLY202 |
D | PHE265 |
D | PYR403 |
D | HOH501 |
site_id | AD7 |
Number of Residues | 4 |
Details | binding site for residue URE D 402 |
Chain | Residue |
C | ARG129 |
D | ASP262 |
D | SER289 |
D | PRO290 |
site_id | AD8 |
Number of Residues | 2 |
Details | binding site for residue EDO D 404 |
Chain | Residue |
D | LYS161 |
D | ASP165 |
site_id | AD9 |
Number of Residues | 1 |
Details | binding site for residue EDO D 405 |
Chain | Residue |
D | ALA12 |
site_id | AE1 |
Number of Residues | 3 |
Details | binding site for residue EDO D 406 |
Chain | Residue |
D | GLY47 |
D | VAL48 |
D | ASP49 |
site_id | AE2 |
Number of Residues | 14 |
Details | binding site for Di-peptide PYR B 405 and LYS B 174 |
Chain | Residue |
B | PRO20 |
B | PHE52 |
B | GLY55 |
B | SER56 |
B | GLY57 |
B | LEU144 |
B | TYR145 |
B | ASN146 |
B | ILE173 |
B | ASP175 |
B | THR176 |
B | LEU200 |
B | ILE219 |
B | URE401 |
site_id | AE3 |
Number of Residues | 13 |
Details | binding site for Di-peptide PYR C 402 and LYS C 174 |
Chain | Residue |
C | LEU200 |
C | ILE219 |
C | PRO20 |
C | PHE52 |
C | GLY55 |
C | SER56 |
C | GLY57 |
C | LEU144 |
C | TYR145 |
C | ASN146 |
C | ILE173 |
C | ASP175 |
C | THR176 |
site_id | AE4 |
Number of Residues | 14 |
Details | binding site for Di-peptide PYR D 403 and LYS D 174 |
Chain | Residue |
D | PRO20 |
D | PHE52 |
D | GLY55 |
D | SER56 |
D | GLY57 |
D | LEU144 |
D | TYR145 |
D | ASN146 |
D | ILE173 |
D | ASP175 |
D | THR176 |
D | LEU200 |
D | ILE219 |
D | URE401 |
Functional Information from PROSITE/UniProt
Functional Information from SwissProt/UniProt
site_id | SWS_FT_FI1 |
Number of Residues | 8 |
Details | ACT_SITE: Charge relay system => ECO:0000305|PubMed:21294156 |
Chain | Residue | Details |
A | SER56 | |
A | TYR119 | |
B | SER56 | |
B | TYR119 | |
C | SER56 | |
C | TYR119 | |
D | SER56 | |
D | TYR119 |
site_id | SWS_FT_FI2 |
Number of Residues | 4 |
Details | ACT_SITE: Proton donor => ECO:0000305|PubMed:21294156 |
Chain | Residue | Details |
A | TYR145 | |
B | TYR145 | |
C | TYR145 | |
D | TYR145 |
site_id | SWS_FT_FI3 |
Number of Residues | 4 |
Details | ACT_SITE: Schiff-base intermediate with substrate => ECO:0000305|PubMed:21294156 |
Chain | Residue | Details |
A | LYS174 | |
B | LYS174 | |
C | LYS174 | |
D | LYS174 |