| Project Name | CHEM361IndividualProjectCJL_Control |
| Project Name | CHEM361IndividualProjectCJL_Control |
| Cluster # | 1 | 2 | 3 | 4 | 5 | 6 | 7 | 8 | 9 | 10 | 11 | 12 |
| Cluster density | 121.3 | 92.4 | 89.4 | 85.8 | 66.9 | 65.7 | 62.6 | 45.4 | 43.7 | 40.0 | 36.3 | 35.3 |
| Cluster size | 287 | 238 | 229 | 207 | 192 | 196 | 174 | 104 | 105 | 108 | 87 | 73 |
| Average cluster RMSD | 2.4 | 2.6 | 2.6 | 2.4 | 2.9 | 3.0 | 2.8 | 2.3 | 2.4 | 2.7 | 2.4 | 2.1 |
| # | 1 | 2 | 3 | 4 | 5 | 6 | 7 | 8 | 9 | 10 | 11 | 12 |
| RMSD | 3.65 | 3.06 | 3.59 | 3.31 | 3.69 | 4.91 | 3.47 | 4.49 | 3.54 | 4.21 | 4.17 | 5.49 |
| GDT_TS | 0.68 | 0.69 | 0.69 | 0.63 | 0.67 | 0.66 | 0.69 | 0.58 | 0.69 | 0.67 | 0.63 | 0.64 |
The table contains RMSD and GDT_TS values (calculated on the Cα atoms) between the predicted models and the input structure. Note that GDT_TS metric is intended as a more accurate measurement than the more common RMSD.
Read more about the root-mean-square deviation (RMSD) measure
Read more about the global distance test (GDT, also written as GDT_TS to represent "total score") measure.
| # | 1 | 2 | 3 | 4 | 5 | 6 | 7 | 8 | 9 | 10 | 11 | 12 |
| 1 | 0.00 | 2.34 | 1.33 | 2.39 | 2.32 | 3.29 | 3.12 | 2.51 | 1.68 | 3.79 | 3.81 | 5.08 |
| 2 | 2.34 | 0.00 | 2.80 | 2.80 | 2.47 | 3.96 | 1.91 | 3.60 | 2.70 | 4.27 | 4.07 | 5.41 |
| 3 | 1.33 | 2.80 | 0.00 | 2.54 | 2.63 | 3.22 | 3.29 | 2.75 | 1.73 | 3.43 | 3.60 | 4.61 |
| 4 | 2.39 | 2.80 | 2.54 | 0.00 | 2.57 | 3.15 | 2.45 | 2.10 | 2.04 | 3.54 | 3.25 | 5.04 |
| 5 | 2.32 | 2.47 | 2.63 | 2.57 | 0.00 | 2.77 | 2.94 | 3.16 | 2.37 | 3.36 | 3.07 | 4.54 |
| 6 | 3.29 | 3.96 | 3.22 | 3.15 | 2.77 | 0.00 | 3.52 | 3.28 | 2.88 | 3.64 | 3.53 | 4.10 |
| 7 | 3.12 | 1.91 | 3.29 | 2.45 | 2.94 | 3.52 | 0.00 | 3.58 | 2.83 | 4.10 | 3.93 | 5.18 |
| 8 | 2.51 | 3.60 | 2.75 | 2.10 | 3.16 | 3.28 | 3.58 | 0.00 | 2.37 | 4.77 | 4.55 | 5.86 |
| 9 | 1.68 | 2.70 | 1.73 | 2.04 | 2.37 | 2.88 | 2.83 | 2.37 | 0.00 | 3.78 | 3.88 | 5.21 |
| 10 | 3.79 | 4.27 | 3.43 | 3.54 | 3.36 | 3.64 | 4.10 | 4.77 | 3.78 | 0.00 | 1.37 | 2.44 |
| 11 | 3.81 | 4.07 | 3.60 | 3.25 | 3.07 | 3.53 | 3.93 | 4.55 | 3.88 | 1.37 | 0.00 | 2.60 |
| 12 | 5.08 | 5.41 | 4.61 | 5.04 | 4.54 | 4.10 | 5.18 | 5.86 | 5.21 | 2.44 | 2.60 | 0.00 |
The table contains RMSD values (calculated on the Cα atoms) between the predicted models.
Read more about the root-mean-square deviation (RMSD) measure.
| # | 1 | 2 | 3 | 4 | 5 | 6 | 7 | 8 | 9 | 10 | 11 | 12 |
| 1 | 1.00 | 0.81 | 0.95 | 0.74 | 0.88 | 0.78 | 0.65 | 0.80 | 0.86 | 0.82 | 0.83 | 0.72 |
| 2 | 0.81 | 1.00 | 0.78 | 0.68 | 0.75 | 0.75 | 0.81 | 0.71 | 0.77 | 0.70 | 0.67 | 0.72 |
| 3 | 0.95 | 0.78 | 1.00 | 0.80 | 0.90 | 0.80 | 0.67 | 0.79 | 0.92 | 0.87 | 0.85 | 0.74 |
| 4 | 0.74 | 0.68 | 0.80 | 1.00 | 0.82 | 0.74 | 0.74 | 0.84 | 0.83 | 0.82 | 0.80 | 0.66 |
| 5 | 0.88 | 0.75 | 0.90 | 0.82 | 1.00 | 0.79 | 0.69 | 0.82 | 0.86 | 0.93 | 0.92 | 0.77 |
| 6 | 0.78 | 0.75 | 0.80 | 0.74 | 0.79 | 1.00 | 0.73 | 0.80 | 0.80 | 0.75 | 0.72 | 0.74 |
| 7 | 0.65 | 0.81 | 0.67 | 0.74 | 0.69 | 0.73 | 1.00 | 0.68 | 0.73 | 0.64 | 0.62 | 0.65 |
| 8 | 0.80 | 0.71 | 0.79 | 0.84 | 0.82 | 0.80 | 0.68 | 1.00 | 0.80 | 0.77 | 0.79 | 0.75 |
| 9 | 0.86 | 0.77 | 0.92 | 0.83 | 0.86 | 0.80 | 0.73 | 0.80 | 1.00 | 0.84 | 0.82 | 0.73 |
| 10 | 0.82 | 0.70 | 0.87 | 0.82 | 0.93 | 0.75 | 0.64 | 0.77 | 0.84 | 1.00 | 0.94 | 0.81 |
| 11 | 0.83 | 0.67 | 0.85 | 0.80 | 0.92 | 0.72 | 0.62 | 0.79 | 0.82 | 0.94 | 1.00 | 0.83 |
| 12 | 0.72 | 0.72 | 0.74 | 0.66 | 0.77 | 0.74 | 0.65 | 0.75 | 0.73 | 0.81 | 0.83 | 1.00 |
The table contains GDT_TS values (calculated on the Cα atoms) between the predicted models.
Read more about the global distance test (GDT, also written as GDT_TS to represent "total score") measure.
© Laboratory of Theory of Biopolymers, Faculty of Chemistry, University of Warsaw 2013