| 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_731119 (CHEMBL1697525) |
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| IC50 | 698±n/a nM |
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| Citation |  Garcia-Effron, G; Lee, S; Park, S; Cleary, JD; Perlin, DS Effect of Candida glabrata FKS1 and FKS2 mutations on echinocandin sensitivity and kinetics of 1,3-beta-D-glucan synthase: implication for the existing susceptibility breakpoint. Antimicrob Agents Chemother53:3690-9 (2009) [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-glucan synthase component FKS1 | Beta-1,3-glucan synthase catalytic subunit | FKS1 |
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| Type: | PROTEIN |
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| Mol. Mass.: | 213936.94 |
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| Organism: | Candida glabrata |
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| Description: | ChEMBL_118415 |
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| Residue: | 1863 |
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| Sequence: | MSYNNNGQQMSDQGYYDNNQGYYQPEDQQNGQAMYGDEGYYDPNISGGDYYNQPPPPPNM
MGQDMENFSDFSSYGPPGVQGYDYQNMNQSGQYTPSQMSYNGDPNSGSSTPIYGNGMSAY
DPNAIAMALPNDPYPAWTADSQSPVPIEQIEDVFIDLTNKFGFQRDSMRNMFDHFMTLLD
SRTSRMAPDQALLSLHADYIGGDTANYKKWYFAAQLDMDDEVGFRNMSLGKLSRKARKAK
KKNKKAMEEANPEDAEDILNKLEGDNSLEAADFRWKTKMNALTPIERVRQIALYLLIWGE
ANQVRFTSECLCFIYKCATDYLNSPLCQQRTEPMPEGDYLNRVITPLYRFIRNQVYEIVD
GRYVKREKDHHKVIGYDDVNQLFWYPEGIAKIVFEDSTKLIEIPAEERYLRLGEVSWDDV
FFKTYKETRSWFHMITNFNRIWIMHVTIFWMYVAYNSPTFYTHNYQQLVNNQPPAAYKWA
SAALGGTVASFIQLLATICEWSFVPRKWAGAQHLSRRFWFLCLIFAVNLGPIIFVFAYEK
DTVQSKAGHAVAAVMFFVAVATLLFFSVMPLGGLFTSYMQKSTRRYVASQTFTASFAPLH
GLDRWLSYLVWVTVFAAKYAESYYFLILSLRDPIRILSTTTMRCTGEYWWGSKLCRHQSK
IVLGLMIATDFILFFLDTYLWYIVVNTVFSVGKSFYLGISILTPWRNIFTRLPKRIYSKI
LATTDMEIKYKPKVLISQVWNAIIISMYREHLLAIDHVQKLLYHQVPSEIEGKRTLRAPT
FFVSQDDNNFETEFFPRNSEAERRISFFAQSLATPMPEPLPVDNMPTFTVLTPHYAERIL
LSLREIIREDDQFSRVTLLEYLKQLHPVEWECFVKDTKILAEETAAYEGMDDQDPEKEDA
LKNQIDDLPFYCIGFKSAAPEYTLRTRIWASLRSQTLYRTVSGFMNYARAIKLLYRVENP
EIVQMFGGNAEGLERELEKMARRKFKFLVSMQRLAKFKPHELENAEFLLRAYPDLQIAYL
DEEPPLNEGEEPRIYSALIDGHCEILENGRRRPKFRVQLSGNPILGDGKSDNQNHALIFY
RGEYIQLIDANQDNYLEECLKIRSVLAEFEELNAEQVYPYSPGVKYEDQNTNHPVAIVGA
REYIFSENSGVLGDVAAGKEQTFGTLFARTLAQIGGKLHYGHPDFINATFMTTRGGISKA
QKGLHLNEDIYAGMNALLRGGRIKHCEYYQCGKGRDLGFGTILNFTTKIGAGMGEQMLSR
EYYYLGTQLPIDRFLTFYYAHPGFHLNNLFIQLSLQMFMLTLVNLHALAHESIICIYDKN
KPKTDVLYPIGCYNFSPAIDWVRRYTLSIFIVFWIAFVPIVVQELIERGLWKATQRFFRH
ILSLSPMFEVFAGQIYSSALLSDLTVGGARYISTGRGFATSRIPFSILYSRFAGSAIYMG
ARSMLMLLFGTVAHWQAPLLWFWASLSALLFSPFIFNPHQFSWEDFFLDYRDYIRWLSRG
NSKYHRNSWIGYVRMARSRITGFKRKLVGDESEKAAGDASRAHRTNLILAEIIPNAIYAA
GCFVGFTFINAQTGVKTTDDDRVNSVLRIIICTLAPIVIDIGVLFFVLGMSCCSGPLFGM
CCKRTGSVMAGFAHGIAVIVHIGFFIVMWVLEGFNFTRMLLGVVTMIQCQRLIFQCMTVL
MLTREFKNDHANTAFWTGKWYGSGFGYMAWTQPTRELTAKVIELSEFAADFVLGHVILFA
QFPVLCIPAIDKFHSIMLFWLKPSRQIRPPIYSLKQSRLRKRMVKRYLTLYIIVFLVFAG
CIVGPAVASSHVAKDLGHQLTGTFHNLVQPRNVSNNDTGFGISTYSNHYYTHTPSLKTWS
TIK
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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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