Target Binding Site Detail
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T62193 | Target Info | |||
| Target Name | Aromatic-L-amino-acid decarboxylase (DDC) | ||||
| Synonyms | DOPA decarboxylase; AADC | ||||
| Target Type | Successful Target | ||||
| Gene Name | DDC | ||||
| Biochemical Class | Carbon-carbon lyase | ||||
| UniProt ID | |||||
| Ligand General Information | Top | ||||
|---|---|---|---|---|---|
| Ligand Name | Pyridoxal phosphate | Ligand Info | |||
| Canonical SMILES | CC1=NC=C(C(=C1O)C=O)COP(=O)(O)O | ||||
| InChI | 1S/C8H10NO6P/c1-5-8(11)7(3-10)6(2-9-5)4-15-16(12,13)14/h2-3,11H,4H2,1H3,(H2,12,13,14) | ||||
| InChIKey | NGVDGCNFYWLIFO-UHFFFAOYSA-N | ||||
| PubChem Compound ID | 1051 | ||||
| Drug Binding Sites of Target | Top | |||||
|---|---|---|---|---|---|---|
| PDB ID: 3RCH Crystal structure of Human aromatic L-amino acid decarboxylase (AADC) in the open conformation with LLP and PLP bound to Chain-A and Chain-B respectively | ||||||
| Method | X-ray diffraction | Resolution | 2.80 Å | Mutation | No | [1] |
| PDB Sequence |
MNASEFRRRG
10 KEMVDYVANY20 MEGIEGRQVY30 PDVEPGYLRP40 LIPAAAPQEP50 DTFEDIINDV 60 EKIIMPGVTH70 WHSPYFFAYF80 PTASSYPAML90 ADMLCGAIGA107 SPACTELETV 117 MMDWLGKMLE127 LPKAFLNEKA137 GEGGGVIQGS147 ASEATLVALL157 AARTKVIHRL 167 QAASPELTQA177 AIMEKLVAYS187 SDQAHSSVER197 AGLIGGVKLK207 AIPSDGNFAM 217 RASALQEALE227 RDKAAGLIPF237 FMVATLGTTT247 CCSFDNLLEV257 GPICNKEDIW 267 LHVDAAYAGS277 AFICPEFRHL287 LNGVEFADSF297 NFNPHKWLLV307 NFDCSAMWVK 317 KRTDLRFRSL360 KMWFVFRMYG370 VKGLQAYIRK380 HVQLSHEFES390 LVRQDPRFEI 400 CVEVILGLVC410 FRLKGSNKVN420 EALLQRINSA430 KKIHLVPCHL440 RDKFVLRFAI 450 CSRTVESAHV460 QRAWEHIKEL470 AADVLRAERE480
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| PDB ID: 3RBF Crystal structure of Human aromatic L-amino acid decarboxylase (AADC) in the apo form | ||||||
| Method | X-ray diffraction | Resolution | 2.90 Å | Mutation | No | [1] |
| PDB Sequence |
MNASEFRRRG
10 KEMVDYVANY20 MEGIEGRQVY30 PDVEPGYLRP40 LIPAAAPQEP50 DTFEDIINDV 60 EKIIMPGVTH70 WHSPYFFAYF80 PTASSYPAML90 ADMLCGAIGC100 IASPACTELE 115 TVMMDWLGKM125 LELPKAFLNE135 KAGEGGGVIQ145 GSASEATLVA155 LLAARTKVIH 165 RLQAASPELT175 QAAIMEKLVA185 YSSDQAHSSV195 ERAGLIGGVK205 LKAIPSDGNF 215 AMRASALQEA225 LERDKAAGLI235 PFFMVATLGT245 TTCCSFDNLL255 EVGPICNKED 265 IWLHVDAAYA275 GSAFICPEFR285 HLLNGVEFAD295 SFNFNPHKWL305 LVNFDCSAMW 315 VKKRTDLRRF357 RSLKMWFVFR367 MYGVKGLQAY377 IRKHVQLSHE387 FESLVRQDPR 397 FEICVEVILG407 LVCFRLKGSN417 KVNEALLQRI427 NSAKKIHLVP437 CHLRDKFVLR 447 FAICSRTVES457 AHVQRAWEHI467 KELAADVLRA477 ERE
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| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Open conformation of human DOPA decarboxylase reveals the mechanism of PLP addition to Group II decarboxylases. Proc Natl Acad Sci U S A. 2011 Dec 20;108(51):20514-9. | ||||
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