 
    | Read Date | 2008-07-10 09:35:00 | 
|---|---|
| Read Number | X0000101650996200807100935 | 
| Week | 0 | 
| Verified Crystal | |
| 3-Way Classifier | |
| 10-Way Classifier | |
| Cocktail | 8A_C1029 | 
| Screen | HWI Generation 8A | 
| Name | pH | Concentration | SMILES | 
|---|---|---|---|
| HEPES-Na | 6.8 | 0.0 M | OCCN1CCN(CC1)CCS(=O)(=O)O… | 
| HEPES-Na | 6.8 | 0.1 M | OCCN1CCN(CC1)CCS(=O)(=O)O… | 
| PEG 3350 | 6.8 | 25.0 % (w/v) | C(CO)OC(CO)OC(CO)OC(CO)OC… | 
| Nicotinamide | 6.8 | 0.2 % (w/v) | c1cc(cnc1)C(=O)N | 
| Congo Red | 6.8 | 0.2 % (w/v) | [Na+].[Na+].[O-]S(=O)(=O)… | 
| Benzamidine hydrochloride | 6.8 | 0.2 % (w/v) | C1=CC=C(C=C1)C(=N)N.Cl | 
| Salicin | 6.8 | 0.2 % (w/v) | c1ccc(c(c1)CO)O[C@H]2[C@@… | 
| 6-Aminohexanoic acid | 6.8 | 0.2 % (w/v) | O=C(O)CCCCCN | 
|  | BoR230 | 
|---|---|
| Spine Status | crystal hits | 
| Length | 207 aa | 
| Mass | 22.95 kD | 
| ext | 45950 | 
| pI | 5.80 | 
| Name | Putative uncharacterized protein | 
| Database References | NCBI UniProt | 
| PFAM | PF13489 | 
| PDB Structures | 3E8S (Best Match) | 
| Gene | |
|---|---|
| Organism | Bordetella bronchiseptica | 
| Genus | Bordetella | 
| Species | bronchiseptica | 
| Strain | |
| Sequence | MTLTSDDLRQIAALTLAHYDDNAVSFEVGTRDHDVSQNIAALLRHIQGDPPYAILDFGCGPGRDLKTFAALGHAAVGLDGAAHFVAMAHQATGCEVWQQDFLRLALPAGRFDGIFANASLFHVPTQELPRVLGELRDTLKPGGVLFCSNPRGGNEEGWSRGRYGVWHDWESWRALLEAAGFQALEHYYRPAGLPREQQQWLASVWRR |