 
    | Read Date | 2008-07-10 09:36:00 | 
|---|---|
| Read Number | X0000101650976200807100936 | 
| Week | 0 | 
| Verified Crystal | |
| 3-Way Classifier | |
| 10-Way Classifier | |
| Cocktail | 8A_C1024 | 
| 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… | 
| L-Citrulline | 6.8 | 0.2 % (w/v) | O=C(O)[C@@H](N)CCCNC(=O)N | 
| L-Carnitine hydrochloride | 6.8 | 0.2 % (w/v) | [Cl-].O=C(O)CC(O)C[N+](C)… | 
| L-Arginine | 6.8 | 0.2 % (w/v) | C(C[C@@H](C(=O)O)N)CN=C(N… | 
| Taurine | 6.8 | 0.2 % (w/v) | O=S(=O)(O)CCN | 
| L-Canavanine | 6.8 | 0.2 % (w/v) | O=C(O)[C@@H](N)CCO\N=C(/N… | 
|  | 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 |