 
    | Read Date | 2009-09-14 09:58:00 | 
|---|---|
| Read Number | X0000113291156200909140958 | 
| Week | 0 | 
| Verified Crystal | |
| 3-Way Classifier | |
| 10-Way Classifier | |
| Cocktail | 9_C1033 | 
| 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… | 
| 5-Sulfosalicylic acid dihydrate | 6.8 | 0.2 % (w/v) | O=C(O)c1cc(ccc1O)S(=O)(=O… | 
| Mellitic acid | 6.8 | 0.2 % (w/v) | O=C(O)c1c(c(c(c(c1C(=O)O)… | 
| Dodecanedioic acid | 6.8 | 0.2 % (w/v) | O=C(O)CCCCCCCCCCC(=O)O | 
| Suberic acid | 6.8 | 0.2 % (w/v) | O=C(O)CCCCCCC(=O)O | 
| Hippuric acid | 6.8 | 0.2 % (w/v) | c1ccc(cc1)C(=O)NCC(=O)O | 
| Oxalacetic acid | 6.8 | 0.2 % (w/v) | O=C(O)C(=O)CC(=O)O | 
|  | QlR56 | 
|---|---|
| Spine Status | crystal hits | 
| Length | 643 aa | 
| Mass | 72.08 kD | 
| ext | 117690 | 
| pI | 5.85 | 
| Name | SubName: Full=Putative uncharacterized protein; | 
| Database References | UniProt | 
| PFAM | PF07944 | 
| PDB Structures | 4QK0 (Best Match) | 
| Gene | |
|---|---|
| Organism | Clostridium leptum | 
| Genus | Clostridium | 
| Species | leptum | 
| Strain | |
| Sequence | MHCLSDFIPWNQVSVTGDFVGHIQELIRTEVLPYQWEALNDQIAGAEPSHCLDNFRAAAEKKGHIQFHGQPFQDSDIYKWIEAAAYTLAWHPDSDLEAKADQAIELICGAQQPDGYLNTYFILTGAQRWTHLLDGHELYCAGHLMEAAVAYYHATGKDKLLKAAQKLADHIADVFGTSPGKIPGYPGHPEVELALIRLFEATGNIKYQQLAQYFICQRGASPSIFRKEADQFGWDWADSPFQFQFYQAGKPILEQTELEGHAVRALYLCCGIADVAARTQDAALLETCRRLWEDLTQTKLYITGGAGSSVYGEAFTFAYDLPNDTAYAETCAAVAVCFFAQRMMKISPSGAYGDVLEQALYNGVLSGMALDGKSFFYVNPLEVVPEACQKDQRKKHVKPIRQKWFACACCPPNLARLFASIGGYLHFIRAETLYTNLYVTSTSEFTFQGLPIKLHMDSAYPFDEKIHISLSLPRPMEFSYAVRIPAWCADYHVLINGKICAGTLKDGFLYLHRCWRDGDEVELTLSMPVRVVRANSLVRENIGKSAICRGPIVYCMEQTDNGPQLHRNRICGKPSFTISSGEENLKGLPCISCSGEYLLPDGTQLYTSAKESFQPKTLRFIPYFAWCNRSPGEMAVWVRHDTI |