Target Binding Site Detail
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T76213 | Target Info | |||
| Target Name | Phenylalanine hydroxylase (PAH) | ||||
| Synonyms | Phenylalanine4hydroxylase; Phenylalanine-4-hydroxylase; Phe4monooxygenase; Phe-4-monooxygenase | ||||
| Target Type | Successful Target | ||||
| Gene Name | PAH | ||||
| Biochemical Class | Paired donor oxygen oxidoreductase | ||||
| UniProt ID | |||||
| Ligand General Information | Top | ||||
|---|---|---|---|---|---|
| Ligand Name | 7,8-dihydrobiopterin | Ligand Info | |||
| Canonical SMILES | CC(C(C1=NC2=C(NC1)N=C(NC2=O)N)O)O | ||||
| InChI | 1S/C9H13N5O3/c1-3(15)6(16)4-2-11-7-5(12-4)8(17)14-9(10)13-7/h3,6,15-16H,2H2,1H3,(H4,10,11,13,14,17)/t3-,6-/m0/s1 | ||||
| InChIKey | FEMXZDUTFRTWPE-DZSWIPIPSA-N | ||||
| PubChem Compound ID | 135398687 | ||||
| Drug Binding Sites of Target | Top | |||||
|---|---|---|---|---|---|---|
| PDB ID: 1LRM Crystal structure of binary complex of the catalytic domain of human phenylalanine hydroxylase with dihydrobiopterin (BH2) | ||||||
| Method | X-ray diffraction | Resolution | 2.10 Å | Mutation | No | [1] |
| PDB Sequence |
VPWFPRTIQE
127 LDRFANQILS137 YGAELDADHP147 GFKDPVYRAR157 RKQFADIAYN167 YRHGQPIPRV 177 EYMEEEKKTW187 GTVFKTLKSL197 YKTHACYEYN207 HIFPLLEKYC217 GFHEDNIPQL 227 EDVSQFLQTC237 TGFRLRPVAG247 LLSSRDFLGG257 LAFRVFHCTQ267 YIRHGSKPMY 277 TPEPDICHEL287 LGHVPLFSDR297 SFAQFSQEIG307 LASLGAPDEY317 IEKLATIYWF 327 TVEFGLCKQG337 DSIKAYGAGL347 LSSFGELQYC357 LSEKPKLLPL367 ELEKTAIQNY 377 TVTEFQPLYY387 VAESFNDAKE397 KVRNFAATIP407 RPFSVRYDPY417 TQRIEVL |
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| PDB ID: 1DMW CRYSTAL STRUCTURE OF DOUBLE TRUNCATED HUMAN PHENYLALANINE HYDROXYLASE WITH BOUND 7,8-DIHYDRO-L-BIOPTERIN | ||||||
| Method | X-ray diffraction | Resolution | 2.00 Å | Mutation | No | [2] |
| PDB Sequence |
VPWFPRTIQE
127 LDRFANQILS137 YGAELDADHP147 GFKDPVYRAR157 RKQFADIAYN167 YRHGQPIPRV 177 EYMEEEKKTW187 GTVFKTLKSL197 YKTHACYEYN207 HIFPLLEKYC217 GFHEDNIPQL 227 EDVSQFLQTC237 TGFRLRPVAG247 LLSSRDFLGG257 LAFRVFHCTQ267 YIRHGSKPMY 277 TPEPDICHEL287 LGHVPLFSDR297 SFAQFSQEIG307 LASLGAPDEY317 IEKLATIYWF 327 TVEFGLCKQG337 DSIKAYGAGL347 LSSFGELQYC357 LSEKPKLLPL367 ELEKTAIQNY 377 TVTEFQPLYY387 VAESFNDAKE397 KVRNFAATIP407 RPFSVRYDPY417 TQRIEVL |
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| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Crystal structure of binary complex of the catalytic domain of human phenylalanine hydroxylase with dihydrobiopterin (BH2) | ||||
| REF 2 | Crystal structure and site-specific mutagenesis of pterin-bound human phenylalanine hydroxylase. Biochemistry. 2000 Mar 7;39(9):2208-17. | ||||
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