Table 3.
Summary of results from simulated annealing of test set proteins
Protein | N | Qbest | rmsdbest | Qf | Nf | rmsdf |
---|---|---|---|---|---|---|
1bqv | 110 | 0.28 | 13.2 | 0.43 | 70 | 5.08 |
1jwe | 114 | 0.28 | 11.9 | 0.36 | 60 | 7.4 |
1bg8(a) | 76 | 0.40 | 8.87 | 0.44 | 65 | 5.3 |
All simulations began from a random coil configuration. Qbest is the structure with the best overall Q, rmsdbest is the rms deviation of that structure. Qf, Nf and rmsdf refer to superpositions of fragments of the best Q structure onto the corresponding fragment of the x-ray structure.