PDB Name # Átomos Tempo ATA (s) RMSD ATA (Å) Tempo UGB (s) RMSD UGB (Å)

SD UGB (Å) Tempo(ATA/UGB)

1ID7 189 4,67E-02 2,9121E-10 7,47E-02 2,8377E-10 62,52%
1B5N 332 6,49E-02 2,0046E-04 1,09E-01 2,0046E-04 59,82%
1FW5 332 6,70E-02 3,1029E-09 1,07E-01 3,1027E-09 62,68%
1SOL 353 6,82E-02 1,4518E-08 1,37E-01 1,4513E-08 49,78%
1JAV 360 6,81E-02 1,4328E-07 1,16E-01 1,4327E-07 58,76%
1PTQ 402 7,36E-02 4,4987E-07 1,27E-01 4,4985E-07 58,00%
1MEQ 405 7,56E-02 2,7598E-08 1,28E-01 2,7581E-08 58,88%
1AMB 438 7,90E-02 8,2328E-06 1,32E-01 8,2329E-06 59,85%
1R7C 532 9,32E-02 4,8412E-07 1,54E-01 4,8315E-07 60,40%
1HLL 540 9,39E-02 1,4397E-07 1,52E-01 1,4398E-07 61,61%
1HOE 558 9,99E-02 3,0329E-09 1,62E-01 3,0810E-09 61,70%
1VII 596 1,12E-01 9,3210E-07 1,77E-01 9,3214E-07 63,65%
1HIP 617 1,02E-01 3,3136E-09 1,77E-01 3,3065E-09 57,72%
1LFB 641 1,09E-01 3,1951E-09 1,82E-01 3,1951E-09 60,13%
1URL 677 1,15E-01 2,0006E-09 2,03E-01 2,0025E-09 56,45%
1AIK 729 1,26E-01 1,9971E-06 2,04E-01 1,9971E-06 61,54%
1PHT 811 1,32E-01 6,3880E-08 2,20E-01 6,3802E-08 60,15%
1CEU 854 1,36E-01 9,7657E-09 2,27E-01 9,7687E-09 60,10%
1POA 914 1,48E-01 8,2019E-08 2,43E-01 8,2043E-08 60,91%
1KVX 954 1,51E-01 2,9637E-08 2,51E-01 2,9603E-08 60,01%
1VMP 1166 1,83E-01 1,5584E-06 3,03E-01 1,5584E-06 60,40%
1HSM 1251 1,93E-01 8,1260E-07 3,20E-01 8,1265E-07 60,34%
1HAA 1310 2,47E-01 2,7982E-05 3,83E-01 2,2997E-05 64,54%
1RGS 2015 3,06E-01 1,5418E-08 5,46E-01 1,5405E-08 56,05%
1BPM 3671 5,50E-01 1,1548E-05 8,85E-01 1,1547E-05 62,16%
Média 57,62%

Tabela 1: Tabela com moléculas do PDB - Teste com 8 Å

1
 (a) Gráfico Tempo

(b) Gráfico RMSD

Figura 1: Gráficos relacionados ao teste das moléculas do PDB (8Å)