X0000103310804200809261335
| Read Date | 2008-09-26 13:35:00 |
|---|---|
| Read Number | X0000103310804200809261335 |
| Week | 5 |
| Verified Crystal | Crystal |
| 3-Way Classifier | |
| 10-Way Classifier | |
| Cocktail | 8A_C1017 |
| 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… |
| Cystamine dihydrochloride | 6.8 | 0.2 % (w/v) | Cl.Cl.S(SCCN)CCN |
| Spermine | 6.8 | 0.2 % (w/v) | C(CCNCCCN)CNCCCN |
| Sarcosine | 6.8 | 0.2 % (w/v) | O=C(O)CNC |
| 1,4-Diaminobutane | 6.8 | 0.2 % (w/v) | C(CCN)CN |
| Diloxanide furoate | 6.8 | 0.2 % (w/v) | O=C(Oc1ccc(N(C(=O)C(Cl)Cl… |
 | CdR100A |
|---|---|
| Spine Status | crystal hits |
| Length | 184 aa |
| Mass | 19.14 kD |
| ext | 4470 |
| pI | 4.78 |
| Name | Putative oxidoreductase |
| Database References | NCBI UniProt |
| PFAM | PF03358 |
| PDB Structures | 3K20 (Best Match) |
| Gene | |
|---|---|
| Organism | Corynebacterium diphtheriae |
| Genus | Corynebacterium |
| Species | diphtheriae |
| Strain | |
| Sequence | MRTLAVISAGLSTPSSTRQIADSISEAVTAAVSARGEALSVSTIELSELIPDLMTAMTTRVHTTKLEEITSALSASDGLVVATPVFKASYTGLFKMFFDILDTDALTGMPTIIAATAGSARHSLVLDYALRPLLSYMRAVVVPTGVFAATEDFGGPEGAEFNKRIARAAGELASLIVEESGNVG |