Table 4. Results of individual single-domain models.
| Crystal No. | PDB entry | Case No. | Prediction | Prediction residue/completeness (%) | Prediction RMSD (Å)/atom | MR model TFZ | MR model R work/R free | MR model residue/completeness (%) | MR model RMSD (Å)/atom | IPCAS model R work/R free | IPCAS model residue/completeness (%) | IPCAS model RMSD (Å)/atom | Best cycle of iteration |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | 6poo | 22 | T1030-D1 | 154/56.41 | 3.06/154 | 6.5 | 0.53/0.52 | 154/56.41 | 3.39/154 | 0.24/0.26 | 271/99.27 | 0.67/271 | 14 |
| 23 | T1030-D2 | 119/43.59 | 2.24/119 | 8.6 | 0.51/0.53 | 119/43.59 | 2.31/119 | 0.27/0.29 | 266/97.44 | 0.77/266 | 35 | ||
| 3 | 6n64 | 24 | T1032-D1 | 170/15.87 | 5.69/170 | 7.1 | 0.52/0.52 | 1020/95.24 | 7.40/1020 | 0.24/0.25 | 1073/100.19 | 1.21/1035 | 10 |
| 4 | 6ya2 | 25 | T1038-D1 | 114/20.69 | 2.45/114 | 18.2 | 0.48/0.45 | 342/62.07 | 2.06/324 | 0.23/0.24 | 542/98.37 | 1.03/536 | 10 |
| 26 | T1038-D2 | 76/13.79 | 1.92/76 | 10.3 | 0.52/0.51 | 228/41.38 | 21.03/227 | 0.23/0.28 | 561/101.81 | 1.27/547 | 10 | ||
| 5 | 6px4 | 27 | T1046s1-D1 | 72/16.86 | 1.28/72 | 19.3 | 0.52/0.52 | 144/33.72 | 1.27/144 | 0.23/0.24 | 422/98.83 | 0.11/422 | 9 |
| 28 | T1046s2-D1 | 141/32.79 | 0.76/140 | 31.1 | 0.49/0.49 | 280/65.57 | 0.72/280 | 0.24/0.25 | 422/98.83 | 0.13/414 | 3 | ||
| 6 | 6y4f | 29 | T1049-D1 | 134/100.00 | 3.82/134 | 20.3 | 0.51/0.52 | 134/100.0 | 3.81/134 | 0.26/0.26 | 132/98.51 | 0.37/132 | 3 |
| 7 | 7m7a | 30 | T1053-D1 | 405/19.06 | 0.66/359 | 33.9 | 0.47/0.47 | 1620/76.24 | 0.73/1443 | 0.26/0.27 | 2245/105.65 | 1.41/2052 | 14 |
| 31 | T1053-D2 | 171/8.05 | 1.25/170 | 25.0 | 0.52/0.53 | 684/32.19 | 1.28/680 | 0.27/0.28 | 2122/99.86 | 1.54/1982 | 10 | ||
| 8 | 6yj1 | 32 | T1056-D1 | 169/50.00 | 0.70/169 | 10.5 | 0.43/0.43 | 338/100.0 | 0.75/338 | 0.28/0.29 | 358/105.92 | 0.41/338 | 4 |
| 9 | 7jtl | 33 | T1064-D1 | 92/45.32 | 1.90/92 | 14.7 | 0.49/0.50 | 184/90.64 | 1.84/183 | 0.26/0.28 | 201/99.01 | 0.27/196 | 5 |
| 10 | 7m5f | 34 | T1065s1-D1 | 119/54.84 | 0.95/119 | 23.0 | 0.52/0.52 | 119/54.84 | 0.95/119 | 0.20/0.22 | 212/97.7 | 0.24/212 | 3 |
| 35 | T1065s2-D1 | 98/45.16 | 0.63/98 | 22.2 | 0.52/0.52 | 98/45.16 | 0.65/98 | 0.23/0.24 | 214/98.62 | 0.12/214 | 5 | ||
| 11 | 7oc9 | 36 | T1074-D1 | 132/99.25 | 1.84/132 | 21.6 | 0.48/0.47 | 132/99.25 | 1.81/132 | 0.27/0.28 | 133/100.0 | 0.37/132 | 11 |
| 12 | 6x6o | 37 | T1082-D1 | 75/50.34 | 0.89/75 | 28.8 | 0.48/0.48 | 150/100.67 | 0.88/148 | 0.24/0.25 | 146/97.99 | 0.34/145 | 3 |
| 13 | 7k7w | 38 | T1090-D1 | 191/101.06 | 2.11/189 | 20.2 | 0.49/0.49 | 191/101.06 | 2.14/189 | 0.22/0.23 | 189/100.0 | 0.13/187 | 9 |