Project |
RUN |
System |
Guest |
Microstate |
CLONE |
Person |
dG1 (kT) |
dG1 sigma (kT) |
dG3 (kT) |
dG3 sigma (kT) |
dG_binding (RT) |
dG_binding sigma (RT) |
log10Kd |
log10Kd sigma |
RL WL-increment |
ns of RL simulation |
Included |
18433 |
32 |
RL_10 |
G5 |
1 |
0 |
Jason |
6.42 |
0.0 |
193.92 |
5.02 |
-4.61 |
5.04 |
-2.00 |
2.19 |
0.0242 |
290.1 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
1 |
Jason |
6.42 |
0.0 |
194.92 |
6.49 |
-3.76 |
6.53 |
-1.63 |
2.84 |
0.0242 |
530.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
2 |
Jason |
6.42 |
0.0 |
193.36 |
7.95 |
-5.13 |
7.96 |
-2.23 |
3.46 |
0.0378 |
280.1 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
3 |
Jason |
6.42 |
0.0 |
193.36 |
5.81 |
-5.14 |
5.82 |
-2.23 |
2.53 |
0.0302 |
290.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
4 |
Jason |
6.42 |
0.0 |
196.23 |
7.13 |
-2.28 |
7.14 |
-0.99 |
3.10 |
0.0242 |
300.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
5 |
Jason |
6.42 |
0.0 |
194.82 |
7.12 |
-3.79 |
7.14 |
-1.65 |
3.10 |
0.0242 |
410.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
6 |
Jason |
6.42 |
0.0 |
196.72 |
7.20 |
-1.87 |
7.21 |
-0.81 |
3.13 |
0.0302 |
400.2 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
7 |
Jason |
6.42 |
0.0 |
194.87 |
6.12 |
-3.66 |
6.14 |
-1.59 |
2.67 |
0.0302 |
290.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
8 |
Jason |
6.42 |
0.0 |
193.40 |
5.50 |
-5.22 |
5.51 |
-2.27 |
2.39 |
0.0242 |
370.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
9 |
Jason |
6.42 |
0.0 |
194.87 |
5.40 |
-3.85 |
5.42 |
-1.67 |
2.35 |
0.0242 |
310.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
10 |
Jason |
6.42 |
0.0 |
195.10 |
6.86 |
-3.51 |
6.87 |
-1.53 |
2.98 |
0.0302 |
330.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
11 |
Jason |
6.42 |
0.0 |
194.03 |
5.71 |
-4.38 |
5.73 |
-1.90 |
2.49 |
0.0193 |
390.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
12 |
Jason |
6.42 |
0.0 |
192.28 |
5.49 |
-6.32 |
5.51 |
-2.74 |
2.39 |
0.0242 |
410.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
13 |
Jason |
6.42 |
0.0 |
194.36 |
4.98 |
-4.14 |
5.00 |
-1.80 |
2.17 |
0.0193 |
410.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
14 |
Jason |
6.42 |
0.0 |
195.52 |
6.52 |
-3.13 |
6.54 |
-1.36 |
2.84 |
0.0242 |
390.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
15 |
Jason |
6.42 |
0.0 |
193.90 |
6.92 |
-4.73 |
6.92 |
-2.06 |
3.01 |
0.0242 |
370.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
16 |
Jason |
6.42 |
0.0 |
193.80 |
5.26 |
-4.72 |
5.28 |
-2.05 |
2.29 |
0.0242 |
370.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
17 |
Jason |
6.42 |
0.0 |
195.24 |
6.01 |
-3.27 |
6.02 |
-1.42 |
2.61 |
0.0302 |
350.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
18 |
Jason |
6.42 |
0.0 |
192.20 |
7.00 |
-6.39 |
7.02 |
-2.78 |
3.05 |
0.0302 |
340.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
19 |
Jason |
6.42 |
0.0 |
193.25 |
5.29 |
-5.35 |
5.31 |
-2.32 |
2.31 |
0.0193 |
380.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
20 |
Jason |
6.42 |
0.0 |
195.36 |
6.17 |
-3.07 |
6.19 |
-1.33 |
2.69 |
0.0302 |
280.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
21 |
Jason |
6.42 |
0.0 |
195.35 |
5.45 |
-3.37 |
5.47 |
-1.47 |
2.37 |
0.0378 |
260.1 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
22 |
Jason |
6.42 |
0.0 |
192.80 |
5.46 |
-5.63 |
5.49 |
-2.44 |
2.38 |
0.0242 |
360.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
23 |
Jason |
6.42 |
0.0 |
195.45 |
8.53 |
-3.07 |
8.54 |
-1.33 |
3.71 |
0.0242 |
320.05 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
24 |
Jason |
6.42 |
0.0 |
192.88 |
6.06 |
-5.72 |
6.08 |
-2.48 |
2.64 |
0.0302 |
240.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
25 |
Jason |
6.42 |
0.0 |
194.38 |
6.56 |
-4.14 |
6.58 |
-1.80 |
2.86 |
0.0302 |
490.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
26 |
Jason |
6.42 |
0.0 |
196.01 |
7.13 |
-2.57 |
7.15 |
-1.11 |
3.10 |
0.0302 |
300.1 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
27 |
Jason |
6.42 |
0.0 |
194.57 |
4.72 |
-3.89 |
4.73 |
-1.69 |
2.06 |
0.0302 |
230.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
28 |
Jason |
6.42 |
0.0 |
195.07 |
7.53 |
-3.40 |
7.55 |
-1.48 |
3.28 |
0.0378 |
310.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
29 |
Jason |
6.42 |
0.0 |
192.69 |
6.57 |
-5.85 |
6.58 |
-2.54 |
2.86 |
0.0242 |
300.1 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
30 |
Jason |
6.42 |
0.0 |
195.11 |
7.27 |
-3.42 |
7.28 |
-1.48 |
3.16 |
0.0378 |
420.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
31 |
Jason |
6.42 |
0.0 |
194.59 |
6.08 |
-3.92 |
6.10 |
-1.70 |
2.65 |
0.0242 |
490.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
32 |
Jason |
6.42 |
0.0 |
194.80 |
6.55 |
-3.84 |
6.58 |
-1.67 |
2.86 |
0.0242 |
280.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
33 |
Jason |
6.42 |
0.0 |
195.03 |
6.23 |
-3.47 |
6.24 |
-1.51 |
2.71 |
0.0472 |
300.35 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
34 |
Jason |
6.42 |
0.0 |
195.47 |
6.28 |
-3.33 |
6.31 |
-1.44 |
2.74 |
0.0242 |
280.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
35 |
Jason |
6.42 |
0.0 |
194.71 |
6.72 |
-3.82 |
6.73 |
-1.66 |
2.92 |
0.0193 |
340.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
36 |
Jason |
6.42 |
0.0 |
193.28 |
6.73 |
-10.25 |
6.73 |
-4.45 |
2.92 |
0.0302 |
220.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
37 |
Jason |
6.42 |
0.0 |
193.94 |
6.10 |
-4.66 |
6.11 |
-2.02 |
2.65 |
0.0193 |
560.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
38 |
Jason |
6.42 |
0.0 |
192.09 |
6.78 |
-6.56 |
6.80 |
-2.85 |
2.95 |
0.0472 |
150.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
39 |
Jason |
6.42 |
0.0 |
192.89 |
5.00 |
-5.73 |
5.02 |
-2.49 |
2.18 |
0.0193 |
420.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
40 |
Jason |
6.42 |
0.0 |
195.93 |
8.20 |
-2.55 |
8.21 |
-1.11 |
3.56 |
0.0472 |
160.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
41 |
Jason |
6.42 |
0.0 |
193.27 |
5.13 |
-5.30 |
5.15 |
-2.30 |
2.24 |
0.0242 |
320.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
42 |
Jason |
6.42 |
0.0 |
193.30 |
5.18 |
-5.17 |
5.20 |
-2.25 |
2.26 |
0.0242 |
370.1 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
43 |
Jason |
6.42 |
0.0 |
193.09 |
5.63 |
-5.51 |
5.65 |
-2.39 |
2.45 |
0.0242 |
270.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
44 |
Jason |
6.42 |
0.0 |
192.90 |
5.53 |
-5.80 |
5.54 |
-2.52 |
2.41 |
0.0378 |
230.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
45 |
Jason |
6.42 |
0.0 |
194.77 |
7.21 |
-3.80 |
7.22 |
-1.65 |
3.13 |
0.0472 |
170.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
46 |
Jason |
6.42 |
0.0 |
191.23 |
6.04 |
-7.29 |
6.06 |
-3.16 |
2.63 |
0.0242 |
330.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
47 |
Jason |
6.42 |
0.0 |
193.57 |
4.73 |
-4.91 |
4.76 |
-2.13 |
2.07 |
0.0193 |
330.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
48 |
Jason |
6.42 |
0.0 |
193.93 |
5.03 |
-4.72 |
5.05 |
-2.05 |
2.19 |
0.0242 |
360.0 |
True |
18433 |
32 |
RL_10 |
G5 |
1 |
49 |
Jason |
6.42 |
0.0 |
194.97 |
6.45 |
-3.58 |
6.47 |
-1.55 |
2.81 |
0.0242 |
350.0 |
True |
Project |
RUN |
System |
Guest |
Microstate |
CLONE |
Person |
dG2 (kT) |
dG2 sigma (kT) |
L WL-increment |
ns of L simulation |
Included |
18434 |
10 |
L |
G5 |
1 |
0 |
Jason |
-204.94 |
0.52 |
0.0026 |
110.0 |
True |
18434 |
10 |
L |
G5 |
1 |
1 |
Jason |
-205.10 |
0.72 |
0.0099 |
70.25 |
True |
18434 |
10 |
L |
G5 |
1 |
2 |
Jason |
-204.90 |
0.36 |
0.0009 |
200.05 |
True |
18434 |
10 |
L |
G5 |
1 |
3 |
Jason |
-204.91 |
0.39 |
0.0007 |
210.0 |
True |
18434 |
10 |
L |
G5 |
1 |
4 |
Jason |
-204.92 |
0.39 |
0.0011 |
150.0 |
True |
18434 |
10 |
L |
G5 |
1 |
5 |
Jason |
-205.02 |
0.49 |
0.0021 |
120.0 |
True |
18434 |
10 |
L |
G5 |
1 |
6 |
Jason |
-205.01 |
0.29 |
0.0003 |
200.0 |
True |
18434 |
10 |
L |
G5 |
1 |
7 |
Jason |
-204.95 |
0.47 |
0.0005 |
210.0 |
True |
18434 |
10 |
L |
G5 |
1 |
8 |
Jason |
-205.04 |
0.31 |
0.0011 |
160.05 |
True |
18434 |
10 |
L |
G5 |
1 |
9 |
Jason |
-205.14 |
0.45 |
0.0011 |
170.2 |
True |
18434 |
10 |
L |
G5 |
1 |
10 |
Jason |
-205.03 |
0.47 |
0.0017 |
170.0 |
True |
18434 |
10 |
L |
G5 |
1 |
11 |
Jason |
-204.83 |
0.46 |
0.0021 |
180.0 |
True |
18434 |
10 |
L |
G5 |
1 |
12 |
Jason |
-205.02 |
0.44 |
0.0011 |
160.0 |
True |
18434 |
10 |
L |
G5 |
1 |
13 |
Jason |
-204.92 |
0.40 |
0.0011 |
170.15 |
True |
18434 |
10 |
L |
G5 |
1 |
14 |
Jason |
-205.06 |
0.56 |
0.0009 |
170.0 |
True |
18434 |
10 |
L |
G5 |
1 |
15 |
Jason |
-205.05 |
0.33 |
0.0001 |
280.0 |
True |
18434 |
10 |
L |
G5 |
1 |
16 |
Jason |
-204.94 |
0.39 |
0.0007 |
180.0 |
True |
18434 |
10 |
L |
G5 |
1 |
17 |
Jason |
-204.93 |
0.33 |
0.0001 |
290.0 |
True |
18434 |
10 |
L |
G5 |
1 |
18 |
Jason |
-205.00 |
0.50 |
0.0032 |
110.0 |
True |
18434 |
10 |
L |
G5 |
1 |
19 |
Jason |
-205.01 |
0.50 |
0.0009 |
210.0 |
True |
18434 |
10 |
L |
G5 |
1 |
20 |
Jason |
-204.86 |
0.50 |
0.0009 |
170.0 |
True |
18434 |
10 |
L |
G5 |
1 |
21 |
Jason |
-205.14 |
0.48 |
0.0004 |
210.0 |
True |
18434 |
10 |
L |
G5 |
1 |
22 |
Jason |
-204.84 |
0.54 |
0.0013 |
160.0 |
True |
18434 |
10 |
L |
G5 |
1 |
23 |
Jason |
-204.94 |
0.52 |
0.0009 |
190.0 |
True |
18434 |
10 |
L |
G5 |
1 |
24 |
Jason |
-205.01 |
0.39 |
0.0003 |
190.0 |
True |
18434 |
10 |
L |
G5 |
1 |
25 |
Jason |
-204.93 |
0.51 |
0.0011 |
180.0 |
True |
18434 |
10 |
L |
G5 |
1 |
26 |
Jason |
-204.99 |
0.46 |
0.0013 |
170.05 |
True |
18434 |
10 |
L |
G5 |
1 |
27 |
Jason |
-204.87 |
0.39 |
0.0005 |
220.0 |
True |
18434 |
10 |
L |
G5 |
1 |
28 |
Jason |
-204.89 |
0.53 |
0.0013 |
180.0 |
True |
18434 |
10 |
L |
G5 |
1 |
29 |
Jason |
-204.96 |
0.34 |
0.0002 |
290.15 |
True |
18434 |
10 |
L |
G5 |
1 |
30 |
Jason |
-204.94 |
0.37 |
0.0003 |
190.0 |
True |
18434 |
10 |
L |
G5 |
1 |
31 |
Jason |
-204.93 |
0.40 |
0.0007 |
220.0 |
True |
18434 |
10 |
L |
G5 |
1 |
32 |
Jason |
-205.06 |
0.60 |
0.0026 |
130.0 |
True |
18434 |
10 |
L |
G5 |
1 |
33 |
Jason |
-204.91 |
0.42 |
0.0009 |
180.0 |
True |
18434 |
10 |
L |
G5 |
1 |
34 |
Jason |
-205.21 |
0.53 |
0.0017 |
150.0 |
True |
18434 |
10 |
L |
G5 |
1 |
35 |
Jason |
-204.95 |
0.36 |
0.0017 |
150.0 |
True |
18434 |
10 |
L |
G5 |
1 |
36 |
Jason |
-209.94 |
0.00 |
0.4398 |
10.0 |
True |
18434 |
10 |
L |
G5 |
1 |
37 |
Jason |
-205.02 |
0.37 |
0.0005 |
180.0 |
True |
18434 |
10 |
L |
G5 |
1 |
38 |
Jason |
-205.06 |
0.53 |
0.0021 |
140.0 |
True |
18434 |
10 |
L |
G5 |
1 |
39 |
Jason |
-205.04 |
0.48 |
0.0011 |
170.0 |
True |
18434 |
10 |
L |
G5 |
1 |
40 |
Jason |
-204.89 |
0.36 |
0.0007 |
220.0 |
True |
18434 |
10 |
L |
G5 |
1 |
41 |
Jason |
-204.99 |
0.53 |
0.0017 |
180.0 |
True |
18434 |
10 |
L |
G5 |
1 |
42 |
Jason |
-204.89 |
0.42 |
0.0007 |
190.0 |
True |
18434 |
10 |
L |
G5 |
1 |
43 |
Jason |
-205.02 |
0.43 |
0.0005 |
200.0 |
True |
18434 |
10 |
L |
G5 |
1 |
44 |
Jason |
-205.11 |
0.39 |
0.0004 |
210.0 |
True |
18434 |
10 |
L |
G5 |
1 |
45 |
Jason |
-204.99 |
0.39 |
0.0001 |
250.0 |
True |
18434 |
10 |
L |
G5 |
1 |
46 |
Jason |
-204.93 |
0.38 |
0.0005 |
180.0 |
True |
18434 |
10 |
L |
G5 |
1 |
47 |
Jason |
-204.90 |
0.48 |
0.0017 |
150.0 |
True |
18434 |
10 |
L |
G5 |
1 |
48 |
Jason |
-205.07 |
0.42 |
0.0013 |
140.0 |
True |
18434 |
10 |
L |
G5 |
1 |
49 |
Jason |
-204.96 |
0.49 |
0.0032 |
130.4 |
True |