Target Binding Site Detail
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T52133 | Target Info | |||
| Target Name | Aspartate beta-hydroxylase (ASPH) | ||||
| Synonyms | Peptideaspartate betadioxygenase; Aspartyl/asparaginyl betahydroxylase; ASPH; ASP betahydroxylase | ||||
| Target Type | Literature-reported Target | ||||
| Gene Name | ASPH | ||||
| Biochemical Class | Paired donor oxygen oxidoreductase | ||||
| UniProt ID | |||||
| Ligand General Information | Top | ||||
|---|---|---|---|---|---|
| Ligand Name | (2S)-2-Hydroxybutanedioic acid | Ligand Info | |||
| Canonical SMILES | C(C(C(=O)O)O)C(=O)O | ||||
| InChI | 1S/C4H6O5/c5-2(4(8)9)1-3(6)7/h2,5H,1H2,(H,6,7)(H,8,9)/t2-/m0/s1 | ||||
| InChIKey | BJEPYKJPYRNKOW-REOHCLBHSA-N | ||||
| PubChem Compound ID | 222656 | ||||
| Drug Binding Sites of Target | Top | |||||
|---|---|---|---|---|---|---|
| PDB ID: 5JZ6 Aspartyl/Asparaginyl beta-hydroxylase (AspH)oxygenase and TPR domains in complex with manganese and L-malate | ||||||
| Method | X-ray diffraction | Resolution | 2.35 Å | Mutation | No | [1] |
| PDB Sequence |
KPKLLNKFDK
339 TIKAELDAAE349 KLRKRGKIEE359 AVNAFKELVR369 KYPQSPRARY379 GKAQCEDDLA 389 EKRRSNEVLR399 GAIETYQEVA409 SLPDVPADLL419 KLSLKRRSDR429 QQFLGHMRGS 439 LLTLQRLVQL449 FPNDTSLKND459 LGVGYLLIGD469 NDNAKKVYEE479 VLSVTPNDGF 489 AKVHYGFILK499 AQNKIAESIP509 YLKEGIESGD519 PGTDDGRFYF529 HLGDAMQRVG 539 NKEAYKWYEL549 GHKRGHFASV559 WQRSLYNVNG569 LKAQPWWTPK579 ETGYTELVKS 589 LERNWKLIRD599 EGLAVMDKAK609 GLFLPEDENL619 REKGDWSQFT629 LWQQGRRNEN 639 ACKGAPKTCT649 LLEKFPETTG659 CRRGQIKYSI669 MHPGTHVWPH679 TGPTNCRLRM 689 HLGLVIPKEG699 CKIRCANETK709 TWEEGKVLIF719 DDSFEHEVWQ729 DASSFRLIFI 739 VDVWHPELTP749 QQRRSLPAI
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| PDB ID: 5APA Crystal structure of human aspartate beta-hydroxylase isoform a | ||||||
| Method | X-ray diffraction | Resolution | 2.05 Å | Mutation | No | [1] |
| PDB Sequence |
SLYNVNGLKA
572 QPWWTPKETG582 YTELVKSLER592 NWKLIRDEGL602 AVMDKAKGLF612 LPEDENLREK 622 GDWSQFTLWQ632 QGRRNENACK642 GAPKTCTLLE652 KFPETTGCRR662 GQIKYSIMHP 672 GTHVWPHTGP682 TNCRLRMHLG692 LVIPKEGCKI702 RCANETKTWE712 EGKVLIFDDS 722 FEHEVWQDAS732 SFRLIFIVDV742 WHPELTPQQR752 RSLPAI
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| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Aspartate/asparagine-beta-hydroxylase crystal structures reveal an unexpected epidermal growth factor-like domain substrate disulfide pattern. Nat Commun. 2019 Oct 28;10(1):4910. | ||||
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