X0000112160428200908070942
| Read Date | 2009-08-07 09:42:00 |
|---|---|
| Read Number | X0000112160428200908070942 |
| Week | 0 |
| Verified Crystal | |
| 3-Way Classifier | |
| 10-Way Classifier | |
| Cocktail | 9_C0995 |
| Screen | HWI Generation 9 |
| 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… |
| Pyromellitic acid | 6.8 | 0.2 % (w/v) | O=C(O)c1cc(c(cc1C(=O)O)C(… |
| Mellitic acid | 6.8 | 0.2 % (w/v) | O=C(O)c1c(c(c(c(c1C(=O)O)… |
| Azelaic acid | 6.8 | 0.2 % (w/v) | O=C(O)CCCCCCCC(=O)O |
| trans-Cinnamic acid | 6.8 | 0.2 % (w/v) | O=C(O)\C=C\c1ccccc1 |
| m-Benzenedisulfonic acid disodium salt | 6.8 | 0.2 % (w/v) | [Na+].[Na+].O=S([O-])(=O)… |
| Pimelic acid | 6.8 | 0.2 % (w/v) | O=C(O)CCCCCC(=O)O |
 | GtR5 |
|---|---|
| Spine Status | crystal hits |
| Length | 293 aa |
| Mass | 32.86 kD |
| ext | 30370 |
| pI | 6.95 |
| Name | Phosphoesterase |
| Database References | NCBI UniProt |
| PFAM | PF12850 |
| PDB Structures | 4LJS (Best Match) |
| Gene | |
|---|---|
| Organism | Geobacillus thermodenitrificans |
| Genus | Geobacillus |
| Species | thermodenitrificans |
| Strain | |
| Sequence | MVIEGGEKTMAFLLIILSFFLLLAFGLRKAHRNTYEAVLHKIQVGSPEDGNGAIRILQLSDLHLEKLSISPDDLYEKLRGEPIDFIALTGDFLDREASIPKLGPYLTALKKLQPAYGMYAVFGNHDYVLQGEPFERLKATLEEHGCIVLQNEMKTITVHGQTVNIIGIDDFYTRRSNMKKAYAGVKDGINIVLTHDPDIVPHMGAYHFDYLLSGHFHGGQIHWPKPYHLAKMSKTLTKRNMIKGYHEWEGKPFYINEGLGQTGVNIRVGSKPEVTLHLLSLPSVAQSETVKAV |