P76 "z0052a"
| Id | 76 |
| Inchikey | KKFDCBRMNNSAAW-UHFFFAOYSA-N |
| Smiles | OCCN1CCOCC1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | EXPERIMENT |
| Ligand_energy | 4.622128988161185 |
| Placement | Placement_76 "Zika_NS5A-x0052 w/ C76" |
Tags
| Tag | Type | Origin |
|---|---|---|
"z0052a" [Observation Code] |
Observation Code | Fragalysis |
"11a - z0103/A/1112" [ConformerSites] |
ConformerSites | Fragalysis/XCA |
"11 - z0103/A/1112/1" [CanonSites] |
CanonSites | Fragalysis/XCA |
"F4x - z0052/A/1112" [CrystalformSites] |
CrystalformSites | Fragalysis/XCA |
"A1 - all" [Quatassemblies] |
Quatassemblies | Fragalysis/XCA |
"F4 - P43212" [Crystalforms] |
Crystalforms | Fragalysis/XCA |
"fragment screen" [Other] |
Other | Fragalysis Curator |
"Primer grip/N-pocket (P2)" [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 |