P101 "z0252a"
| Id | 101 |
| Inchikey | VIYPNISBCRFBOV-QMMMGPOBSA-N |
| Smiles | C[C@H](O)CNCc1ccc2c(c1)OCO2 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | EXPERIMENT |
| Ligand_energy | 14.23207778489779 |
| Placement | Placement_101 "Zika_NS5A-x0252 w/ C101" |
| Tag | Type | Origin |
|---|---|---|
"z0252a" [Observation Code] |
Observation Code | Fragalysis |
"43a - z0252/A/1101" [ConformerSites] |
ConformerSites | Fragalysis/XCA |
"43 - z0252/A/1101/1" [CanonSites] |
CanonSites | Fragalysis/XCA |
"F4bj - z0252/A/1101" [CrystalformSites] |
CrystalformSites | Fragalysis/XCA |
"A1 - all" [Quatassemblies] |
Quatassemblies | Fragalysis/XCA |
"F4 - P43212" [Crystalforms] |
Crystalforms | Fragalysis/XCA |
"fragment screen" [Other] |
Other | Fragalysis Curator |
"ZIKV" [Other] |
Other | Fragalysis Curator |
"upload_1 2024-12-06" [Other] |
Other | Fragalysis Curator |
"upload_2 2025-03-14" [Other] |
Other | Fragalysis Curator |