X0000103311172200808291146
| Read Date | 2008-08-29 11:46:00 |
|---|---|
| Read Number | X0000103311172200808291146 |
| Week | 0 |
| Verified Crystal | |
| 3-Way Classifier | |
| 10-Way Classifier | |
| Cocktail | 8A_C1037 |
| 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… |
| 1,3,5-Pentanetricarboxylic acid | 6.8 | 0.2 % (w/v) | O=C(O)CCC(C(=O)O)CCC(=O)O |
| Poly(3-hydroxybutyric acid) | 6.8 | 0.2 % (w/v) | O=C(O)CC(O)CC.O=C(O)CC(O)… |
| Benzoic acid | 6.8 | 0.2 % (w/v) | c1ccc(cc1)C(=O)O |
| 4-Hydroxyphenylacetic acid | 6.8 | 0.2 % (w/v) | O=C(O)Cc1ccc(O)cc1 |
 | 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 |