5ETT
S. aureus 6-hydroxymethyl-7,8-dihydropterin pyrophosphokinase complexed with AMPCPP and inhibitor at 1.55 angstrom resolution
Functional Information from GO Data
Chain | GOid | namespace | contents |
A | 0003848 | molecular_function | 2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase activity |
A | 0005524 | molecular_function | ATP binding |
A | 0009396 | biological_process | folic acid-containing compound biosynthetic process |
A | 0016301 | molecular_function | kinase activity |
A | 0046654 | biological_process | tetrahydrofolate biosynthetic process |
A | 0046656 | biological_process | folic acid biosynthetic process |
A | 0046872 | molecular_function | metal ion binding |
B | 0003848 | molecular_function | 2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase activity |
B | 0005524 | molecular_function | ATP binding |
B | 0009396 | biological_process | folic acid-containing compound biosynthetic process |
B | 0016301 | molecular_function | kinase activity |
B | 0046654 | biological_process | tetrahydrofolate biosynthetic process |
B | 0046656 | biological_process | folic acid biosynthetic process |
B | 0046872 | molecular_function | metal ion binding |
Functional Information from PDB Data
site_id | AC1 |
Number of Residues | 28 |
Details | binding site for residue APC B 201 |
Chain | Residue |
B | LEU71 |
B | SER112 |
B | HIS115 |
B | ARG117 |
B | ARG121 |
B | MG204 |
B | MG205 |
B | HOH304 |
B | HOH313 |
B | HOH325 |
B | HOH326 |
B | ARG83 |
B | HOH331 |
B | HOH343 |
B | HOH348 |
B | HOH362 |
B | HOH368 |
B | HOH377 |
B | HOH387 |
B | HOH389 |
B | HOH406 |
B | ARG85 |
B | ARG92 |
B | ASP95 |
B | ASP97 |
B | ILE98 |
B | LYS110 |
B | LEU111 |
site_id | AC2 |
Number of Residues | 18 |
Details | binding site for residue 5RY B 202 |
Chain | Residue |
B | ASN11 |
B | THR43 |
B | ALA44 |
B | PRO45 |
B | VAL46 |
B | TYR48 |
B | GLN51 |
B | PHE54 |
B | ASN56 |
B | TRP89 |
B | GLY90 |
B | PRO91 |
B | ARG92 |
B | ARG121 |
B | PHE123 |
B | HOH348 |
B | HOH362 |
B | HOH402 |
site_id | AC3 |
Number of Residues | 7 |
Details | binding site for residue NA B 203 |
Chain | Residue |
A | NA203 |
B | ASN27 |
B | TYR29 |
B | ILE32 |
B | HOH349 |
B | HOH399 |
B | HOH414 |
site_id | AC4 |
Number of Residues | 6 |
Details | binding site for residue MG B 204 |
Chain | Residue |
B | ASP95 |
B | ASP97 |
B | APC201 |
B | MG205 |
B | HOH331 |
B | HOH368 |
site_id | AC5 |
Number of Residues | 6 |
Details | binding site for residue MG B 205 |
Chain | Residue |
B | ASP95 |
B | ASP97 |
B | APC201 |
B | MG204 |
B | HOH362 |
B | HOH387 |
site_id | AC6 |
Number of Residues | 5 |
Details | binding site for residue NA B 206 |
Chain | Residue |
A | ASP107 |
A | HOH327 |
A | HOH349 |
B | ASP107 |
B | HOH328 |
site_id | AC7 |
Number of Residues | 25 |
Details | binding site for residue APC A 201 |
Chain | Residue |
A | LEU71 |
A | ARG83 |
A | ARG92 |
A | ASP95 |
A | ASP97 |
A | ILE98 |
A | LYS110 |
A | LEU111 |
A | SER112 |
A | HIS115 |
A | ARG117 |
A | ARG121 |
A | MG204 |
A | MG205 |
A | HOH314 |
A | HOH319 |
A | HOH320 |
A | HOH321 |
A | HOH322 |
A | HOH325 |
A | HOH333 |
A | HOH351 |
A | HOH373 |
A | HOH375 |
A | HOH383 |
site_id | AC8 |
Number of Residues | 20 |
Details | binding site for residue 5RY A 202 |
Chain | Residue |
A | VAL46 |
A | TYR48 |
A | GLN51 |
A | PHE54 |
A | ASN56 |
A | TRP89 |
A | GLY90 |
A | PRO91 |
A | ARG92 |
A | ARG121 |
A | PHE123 |
A | HOH325 |
A | HOH351 |
A | HOH375 |
A | HOH396 |
A | HOH411 |
A | ASN11 |
A | THR43 |
A | ALA44 |
A | PRO45 |
site_id | AC9 |
Number of Residues | 7 |
Details | binding site for residue NA A 203 |
Chain | Residue |
A | ASN27 |
A | TYR29 |
A | ILE32 |
B | NA203 |
B | HOH349 |
B | HOH399 |
B | HOH414 |
site_id | AD1 |
Number of Residues | 6 |
Details | binding site for residue MG A 204 |
Chain | Residue |
A | ASP95 |
A | ASP97 |
A | APC201 |
A | MG205 |
A | HOH351 |
A | HOH375 |
site_id | AD2 |
Number of Residues | 6 |
Details | binding site for residue MG A 205 |
Chain | Residue |
A | ASP95 |
A | ASP97 |
A | APC201 |
A | MG204 |
A | HOH319 |
A | HOH373 |
Functional Information from PROSITE/UniProt
site_id | PS00794 |
Number of Residues | 12 |
Details | HPPK 7,8-dihydro-6-hydroxymethylpterin-pyrophosphokinase signature. RwGPRtlDVDIL |
Chain | Residue | Details |
B | ARG88-LEU99 |