| Reaction Details |
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 | Report a problem with these data |
| Target | 1,3-beta-glucan synthase |
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| Ligand | BDBM50478215 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_683508 (CHEMBL1286423) |
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| IC50 | 0.296000±n/a nM |
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| Citation |  Garcia-Effron, G; Kontoyiannis, DP; Lewis, RE; Perlin, DS Caspofungin-resistant Candida tropicalis strains causing breakthrough fungemia in patients at high risk for hematologic malignancies. Antimicrob Agents Chemother52:4181-3 (2008) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| 1,3-beta-glucan synthase |
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| Name: | 1,3-beta-glucan synthase |
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| Synonyms: | 1,3-beta-D-glucan synthase subunit 1 | FKS1 |
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| Type: | PROTEIN |
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| Mol. Mass.: | 218939.56 |
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| Organism: | Candida tropicalis |
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| Description: | ChEMBL_118438 |
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| Residue: | 1904 |
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| Sequence: | MSYNDNNNNHYYDPNQQGGVPPQQGDGYYQQQYDDMSQQQQYDNMGQQPHQQDYYDPNVQ
YNQQPYDMDGYQDQAQYGGQPMNAQGYNADPEAFSDFSYGGQTPGTPGYDQYGTQYTPSQ
MSYGGDPRSSGASTPIYGGQGQGYDPTQFNMSSNLPYPAWSADPQAPIKVEHIEDIFIDL
TNKFGFQRDSMRNMFDYFMTLLDSRSSRMSPAQALLSLHADYIGGDNANYRKWFFASQQD
LDDSLGFANMTLGKLGRKARKASKKSKKARKAAEEHGEDVDALANELEGDYSLEAAEIRW
KAKMNSLTPEERVRDIALYLLLWGEANQVRFTPECLCYIYKTAMDYLQSPLCQQRQEPVP
EGDYLNRVITPLYRFIRSQVYEIYDGRFVKREKDHNKVIGYDDVNQLFWYPEGISRIMFE
DGTRLVDIPQEERFLRLGEVEWKNVFFKTYKEIRTWLHFITNFNRIWIIHGTIYWMYTAY
NSPTLYTKHYVQTRNQQPLASSRWAACAIGGVFACLVQIFATLFEWMFVPREWAGAQHLT
RRMMFLILIFLANLVPPVYTFKVTKLVLYSKSAYAVSVVGFFIAIATLVFFAVMPLGGLF
TSYMNKRSRRYISSQTFTASYIKLHGLDMWMSYLLWFLVFLAKLVESYFFLTLSLRDPIR
NLSTMTMRCVGEVWYGDVVCRNQAKIVLGLMYLVDLLLFFLDTYMWYIICNCIFSIGRSF
YLGISILTPWRNIFTRLPKRIYSKILATTEMEIKYKPKVLISQIWNAIVISMYREHLLAI
DHVQKLLYHQVPSEIEGKRTLRAPTFFVSQDDNNFETEFFPRNSEAERRISFFAQSLATP
MPEPLPVDNMPTFTVFTPHYSEKILLSLREIIREDDQFSRVTLLEYLKQLHPVEWDCFVK
DTKILAEETAAYENGDDSEKLSEDGLKSKIDDLPFYCIGFKSAAPEYTLRTRIWASLRSQ
TLYRTVSGFMNYARAIKLLYRVENPELVQYFGGDPEGLELALERMARRKFRFLVSMQRLS
KFKDDEMENAEFLLRAYPDLQIAYLDEEPALNEDEEPRVYSSLIDGHCEMLENGRRRPKF
RVQLSGNPILGDGKSDNQNHAVIFHRGEYIQLIDANQDNYLEECLKIRSVLAEFEELNVE
HVNPYAPTMKNDENNIKKDPVAFLGAREYIFSENSGVLGDVAAGKEQTFGTLFARTLAQI
GGKLHYGHPDFLNATFMLTRGGVSKAQKGLHLNEDIYAGMNAMMRGGKIKHCEYYQCGKG
RDLGFGSILNFTTKIGAGMGEQMLSREYFYLGTQLPLDRFLSFYYGHPGFHINNLFIQLS
LQVFILVLANLNSLAHESIICSYNKDVPITDVLYPFGCYNLSPAVDWIRRYTLSIFIVFF
ISFIPLVVQELIERGVWKAFQRFVRHFISLSPMFEVFVAQIYSSSVFTDLTVGGARYIST
GRGFATSRIPFSILYSRFADSSIYMGARLMLILLFGTVSHWQAPLLWFWASLSSLMFSPF
IFNPHQFAWEDFFIDYRDFIRWLSRGNTKWHRNSWIGYVRLSRSRITGFKRKLTGDVSEK
AAGDASRAHRSNVFFADFLPTLIYTAGLYVAYTFINAQTGVTSYSYEINGSTDPQEVNAT
LRLIICALAPVVIDCGCLAVCVGMACCAGPMLGLCCKKTGAVIAGIAHGVAVIVHIVFFI
VMWVTEGFNFARMLLGLATMVYVQRLLFKFLTLCFLTREFKNDKANTAFWTGKWYNTGMG
WMAFTQPSREFVAKIIEMSEFAGDFMLAHIILFCQLPILCIPLIDRWHSMMLFWLKPSRL
IRPPIYSLKQARLRKRMVRKYCVLYFTVLIMLVVIIAAPAAASGQIAVDQFANIGGSGSI
ANGLFQPRNVSNNDTGNHKPKSYTWSFLSTRFTGTTKGYSTNPF
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| BDBM50478215 |
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| n/a |
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| Name | BDBM50478215 |
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| Synonyms: | CHEBI:474180 | Cancidas | Caspofungin | Caspofungin Acetate | L-743,872 | L-743872 | MK-991 |
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| Type | Small organic molecule |
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| Emp. Form. | C52H88N10O15 |
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| Mol. Mass. | 1093.3131 |
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| SMILES | [H][C@@]12C[C@@H](O)CN1C(=O)[C@@]([H])(NC(=O)[C@H](C[C@@H](O)[C@@H](NCCN)NC(=O)[C@]1([H])[C@@H](O)CCN1C(=O)[C@@]([H])(NC(=O)[C@@]([H])(NC2=O)[C@H](O)[C@@H](O)c1ccc(O)cc1)[C@H](O)CCN)NC(=O)CCCCCCCCC(C)CC(C)CC)[C@@H](C)O |r| |
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| Structure | 
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