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 |
20 |
RL_8 |
G12 |
1 |
0 |
Paige |
6.42 |
0.0 |
6.55 |
3.94 |
-23.61 |
3.97 |
-10.25 |
1.73 |
0.0193 |
230.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
1 |
Paige |
6.42 |
0.0 |
5.98 |
3.27 |
-24.28 |
3.30 |
-10.54 |
1.43 |
0.0193 |
290.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
2 |
Paige |
6.42 |
0.0 |
5.39 |
2.57 |
-24.62 |
2.60 |
-10.69 |
1.13 |
0.0124 |
440.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
3 |
Paige |
6.42 |
0.0 |
6.11 |
2.70 |
-24.09 |
2.73 |
-10.46 |
1.19 |
0.0124 |
410.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
4 |
Paige |
6.42 |
0.0 |
5.93 |
3.03 |
-24.36 |
3.08 |
-10.58 |
1.34 |
0.0124 |
280.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
5 |
Paige |
6.42 |
0.0 |
5.49 |
3.45 |
-24.69 |
3.52 |
-10.72 |
1.53 |
0.0124 |
310.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
6 |
Paige |
6.42 |
0.0 |
5.33 |
2.75 |
-25.09 |
2.79 |
-10.89 |
1.21 |
0.0099 |
260.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
7 |
Paige |
6.42 |
0.0 |
5.38 |
2.56 |
-25.01 |
2.64 |
-10.86 |
1.15 |
0.0063 |
290.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
8 |
Paige |
6.42 |
0.0 |
5.52 |
2.23 |
-24.93 |
2.26 |
-10.83 |
0.98 |
0.0079 |
400.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
9 |
Paige |
6.42 |
0.0 |
5.40 |
2.54 |
-24.85 |
2.59 |
-10.79 |
1.12 |
0.0099 |
290.1 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
10 |
Paige |
6.42 |
0.0 |
5.24 |
2.43 |
-24.61 |
2.49 |
-10.69 |
1.08 |
0.0079 |
420.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
11 |
Paige |
6.42 |
0.0 |
5.46 |
2.45 |
-24.75 |
2.51 |
-10.75 |
1.09 |
0.0099 |
320.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
12 |
Paige |
6.42 |
0.0 |
7.10 |
4.64 |
-23.02 |
4.65 |
-10.00 |
2.02 |
0.0099 |
330.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
13 |
Paige |
6.42 |
0.0 |
5.70 |
3.00 |
-24.65 |
3.04 |
-10.70 |
1.32 |
0.0063 |
330.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
14 |
Paige |
6.42 |
0.0 |
4.21 |
1.98 |
-26.07 |
2.07 |
-11.32 |
0.90 |
0.0063 |
430.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
15 |
Paige |
6.42 |
0.0 |
6.98 |
3.76 |
-23.15 |
3.81 |
-10.05 |
1.65 |
0.0155 |
420.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
16 |
Paige |
6.42 |
0.0 |
5.12 |
2.41 |
-25.11 |
2.43 |
-10.91 |
1.05 |
0.0099 |
390.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
17 |
Paige |
6.42 |
0.0 |
5.37 |
2.02 |
-24.80 |
2.06 |
-10.77 |
0.90 |
0.0079 |
310.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
18 |
Paige |
6.42 |
0.0 |
7.10 |
3.65 |
-23.06 |
3.70 |
-10.02 |
1.61 |
0.0193 |
210.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
19 |
Paige |
6.42 |
0.0 |
4.99 |
3.00 |
-25.21 |
3.04 |
-10.95 |
1.32 |
0.0099 |
280.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
20 |
Paige |
6.42 |
0.0 |
6.68 |
4.01 |
-23.72 |
4.05 |
-10.30 |
1.76 |
0.0099 |
250.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
21 |
Paige |
6.42 |
0.0 |
5.28 |
3.24 |
-24.95 |
3.31 |
-10.84 |
1.44 |
0.0099 |
290.1 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
22 |
Paige |
6.42 |
0.0 |
6.12 |
3.92 |
-24.25 |
3.94 |
-10.53 |
1.71 |
0.0155 |
310.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
23 |
Paige |
6.42 |
0.0 |
5.35 |
2.55 |
-24.81 |
2.61 |
-10.77 |
1.13 |
0.0099 |
340.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
24 |
Paige |
6.42 |
0.0 |
6.14 |
3.65 |
-23.82 |
3.70 |
-10.34 |
1.61 |
0.0193 |
240.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
25 |
Paige |
6.42 |
0.0 |
6.07 |
3.84 |
-24.31 |
3.90 |
-10.56 |
1.69 |
0.0099 |
330.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
26 |
Paige |
6.42 |
0.0 |
5.24 |
2.91 |
-24.97 |
2.93 |
-10.84 |
1.27 |
0.0099 |
180.1 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
27 |
Paige |
6.42 |
0.0 |
5.27 |
2.57 |
-25.13 |
2.60 |
-10.92 |
1.13 |
0.0155 |
190.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
28 |
Paige |
6.42 |
0.0 |
5.33 |
2.49 |
-24.95 |
2.54 |
-10.84 |
1.10 |
0.0124 |
260.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
29 |
Paige |
6.42 |
0.0 |
5.37 |
2.36 |
-24.87 |
2.39 |
-10.80 |
1.04 |
0.0124 |
300.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
30 |
Paige |
6.42 |
0.0 |
4.61 |
2.36 |
-25.67 |
2.39 |
-11.15 |
1.04 |
0.0079 |
390.2 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
31 |
Paige |
6.42 |
0.0 |
5.63 |
2.77 |
-24.63 |
2.78 |
-10.70 |
1.21 |
0.0099 |
330.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
32 |
Paige |
6.42 |
0.0 |
5.57 |
2.48 |
-24.66 |
2.51 |
-10.71 |
1.09 |
0.0079 |
390.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
33 |
Paige |
6.42 |
0.0 |
5.51 |
2.65 |
-24.66 |
2.78 |
-10.71 |
1.21 |
0.0124 |
350.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
34 |
Paige |
6.42 |
0.0 |
5.28 |
2.72 |
-24.63 |
2.78 |
-10.70 |
1.21 |
0.0155 |
250.15 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
35 |
Paige |
6.42 |
0.0 |
5.72 |
3.11 |
-24.41 |
3.12 |
-10.60 |
1.36 |
0.0124 |
360.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
36 |
Paige |
6.42 |
0.0 |
4.78 |
3.05 |
-25.53 |
3.21 |
-11.09 |
1.40 |
0.0099 |
280.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
37 |
Paige |
6.42 |
0.0 |
5.10 |
2.62 |
-25.10 |
2.64 |
-10.90 |
1.15 |
0.0099 |
280.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
38 |
Paige |
6.42 |
0.0 |
5.87 |
2.64 |
-24.25 |
2.71 |
-10.53 |
1.18 |
0.0124 |
270.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
39 |
Paige |
6.42 |
0.0 |
5.18 |
2.63 |
-25.00 |
2.68 |
-10.86 |
1.16 |
0.0099 |
410.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
40 |
Paige |
6.42 |
0.0 |
6.27 |
3.31 |
-23.82 |
3.33 |
-10.35 |
1.45 |
0.0051 |
320.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
41 |
Paige |
6.42 |
0.0 |
7.26 |
3.00 |
-23.01 |
3.03 |
-9.99 |
1.32 |
0.0063 |
440.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
42 |
Paige |
6.42 |
0.0 |
5.13 |
2.81 |
-25.06 |
2.90 |
-10.88 |
1.26 |
0.0079 |
330.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
43 |
Paige |
6.42 |
0.0 |
6.01 |
3.21 |
-24.41 |
3.26 |
-10.60 |
1.42 |
0.0124 |
310.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
44 |
Paige |
6.42 |
0.0 |
6.47 |
3.73 |
-23.66 |
3.75 |
-10.28 |
1.63 |
0.0124 |
270.05 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
45 |
Paige |
6.42 |
0.0 |
6.00 |
2.75 |
-24.35 |
2.78 |
-10.58 |
1.21 |
0.0063 |
380.4 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
46 |
Paige |
6.42 |
0.0 |
5.47 |
2.30 |
-24.62 |
2.35 |
-10.69 |
1.02 |
0.0124 |
360.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
47 |
Paige |
6.42 |
0.0 |
6.63 |
3.28 |
-23.64 |
3.30 |
-10.27 |
1.43 |
0.0099 |
320.3 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
48 |
Paige |
6.42 |
0.0 |
5.75 |
2.32 |
-24.52 |
2.35 |
-10.65 |
1.02 |
0.0099 |
310.0 |
True |
18433 |
20 |
RL_8 |
G12 |
1 |
49 |
Paige |
6.42 |
0.0 |
5.65 |
3.04 |
-24.54 |
3.07 |
-10.66 |
1.33 |
0.0124 |
240.15 |
True |
Project |
RUN |
System |
Guest |
Microstate |
CLONE |
Person |
dG2 (kT) |
dG2 sigma (kT) |
L WL-increment |
ns of L simulation |
Included |
18434 |
21 |
L |
G12 |
1 |
0 |
Paige |
-36.57 |
0.47 |
0.0013 |
170.0 |
True |
18434 |
21 |
L |
G12 |
1 |
1 |
Paige |
-36.67 |
0.40 |
0.0003 |
210.0 |
True |
18434 |
21 |
L |
G12 |
1 |
2 |
Paige |
-36.44 |
0.39 |
0.0009 |
170.0 |
True |
18434 |
21 |
L |
G12 |
1 |
3 |
Paige |
-36.61 |
0.44 |
0.0005 |
210.1 |
True |
18434 |
21 |
L |
G12 |
1 |
4 |
Paige |
-36.70 |
0.52 |
0.0007 |
200.6 |
True |
18434 |
21 |
L |
G12 |
1 |
5 |
Paige |
-36.59 |
0.69 |
0.0051 |
120.0 |
True |
18434 |
21 |
L |
G12 |
1 |
6 |
Paige |
-36.83 |
0.49 |
0.0017 |
170.0 |
True |
18434 |
21 |
L |
G12 |
1 |
7 |
Paige |
-36.81 |
0.66 |
0.0041 |
100.0 |
True |
18434 |
21 |
L |
G12 |
1 |
8 |
Paige |
-36.86 |
0.39 |
0.0003 |
230.0 |
True |
18434 |
21 |
L |
G12 |
1 |
9 |
Paige |
-36.66 |
0.50 |
0.0004 |
210.0 |
True |
18434 |
21 |
L |
G12 |
1 |
10 |
Paige |
-36.26 |
0.57 |
0.0026 |
130.0 |
True |
18434 |
21 |
L |
G12 |
1 |
11 |
Paige |
-36.63 |
0.55 |
0.0026 |
150.15 |
True |
18434 |
21 |
L |
G12 |
1 |
12 |
Paige |
-36.54 |
0.37 |
0.0004 |
230.0 |
True |
18434 |
21 |
L |
G12 |
1 |
13 |
Paige |
-36.76 |
0.51 |
0.0009 |
200.0 |
True |
18434 |
21 |
L |
G12 |
1 |
14 |
Paige |
-36.70 |
0.63 |
0.0021 |
130.0 |
True |
18434 |
21 |
L |
G12 |
1 |
15 |
Paige |
-36.54 |
0.55 |
0.0007 |
190.1 |
True |
18434 |
21 |
L |
G12 |
1 |
16 |
Paige |
-36.64 |
0.31 |
0.0003 |
250.0 |
True |
18434 |
21 |
L |
G12 |
1 |
17 |
Paige |
-36.60 |
0.39 |
0.0007 |
190.2 |
True |
18434 |
21 |
L |
G12 |
1 |
18 |
Paige |
-36.58 |
0.57 |
0.0002 |
220.0 |
True |
18434 |
21 |
L |
G12 |
1 |
19 |
Paige |
-36.61 |
0.53 |
0.0026 |
140.0 |
True |
18434 |
21 |
L |
G12 |
1 |
20 |
Paige |
-36.82 |
0.58 |
0.0007 |
220.25 |
True |
18434 |
21 |
L |
G12 |
1 |
21 |
Paige |
-36.64 |
0.65 |
0.0041 |
110.25 |
True |
18434 |
21 |
L |
G12 |
1 |
22 |
Paige |
-36.78 |
0.46 |
0.0004 |
180.1 |
True |
18434 |
21 |
L |
G12 |
1 |
23 |
Paige |
-36.58 |
0.54 |
0.0009 |
170.0 |
True |
18434 |
21 |
L |
G12 |
1 |
24 |
Paige |
-36.40 |
0.59 |
0.0013 |
160.0 |
True |
18434 |
21 |
L |
G12 |
1 |
25 |
Paige |
-36.79 |
0.69 |
0.0051 |
100.0 |
True |
18434 |
21 |
L |
G12 |
1 |
26 |
Paige |
-36.62 |
0.35 |
0.0002 |
240.0 |
True |
18434 |
21 |
L |
G12 |
1 |
27 |
Paige |
-36.82 |
0.38 |
0.0001 |
280.15 |
True |
18434 |
21 |
L |
G12 |
1 |
28 |
Paige |
-36.70 |
0.52 |
0.0005 |
220.0 |
True |
18434 |
21 |
L |
G12 |
1 |
29 |
Paige |
-36.65 |
0.40 |
0.0003 |
290.1 |
True |
18434 |
21 |
L |
G12 |
1 |
30 |
Paige |
-36.70 |
0.40 |
0.0004 |
220.1 |
True |
18434 |
21 |
L |
G12 |
1 |
31 |
Paige |
-36.68 |
0.29 |
0.0003 |
270.1 |
True |
18434 |
21 |
L |
G12 |
1 |
32 |
Paige |
-36.65 |
0.43 |
0.0005 |
190.0 |
True |
18434 |
21 |
L |
G12 |
1 |
33 |
Paige |
-36.59 |
0.83 |
0.0041 |
100.0 |
True |
18434 |
21 |
L |
G12 |
1 |
34 |
Paige |
-36.38 |
0.56 |
0.0026 |
120.0 |
True |
18434 |
21 |
L |
G12 |
1 |
35 |
Paige |
-36.55 |
0.34 |
0.0002 |
210.05 |
True |
18434 |
21 |
L |
G12 |
1 |
36 |
Paige |
-36.73 |
1.02 |
0.0242 |
50.0 |
False |
18434 |
21 |
L |
G12 |
1 |
37 |
Paige |
-36.61 |
0.36 |
0.0002 |
230.1 |
True |
18434 |
21 |
L |
G12 |
1 |
38 |
Paige |
-36.56 |
0.60 |
0.0017 |
130.0 |
True |
18434 |
21 |
L |
G12 |
1 |
39 |
Paige |
-36.59 |
0.50 |
0.0013 |
160.0 |
True |
18434 |
21 |
L |
G12 |
1 |
40 |
Paige |
-36.51 |
0.40 |
0.0005 |
180.25 |
True |
18434 |
21 |
L |
G12 |
1 |
41 |
Paige |
-36.69 |
0.45 |
0.0011 |
150.0 |
True |
18434 |
21 |
L |
G12 |
1 |
42 |
Paige |
-36.61 |
0.71 |
0.0063 |
80.0 |
True |
18434 |
21 |
L |
G12 |
1 |
43 |
Paige |
-36.84 |
0.57 |
0.0011 |
200.0 |
True |
18434 |
21 |
L |
G12 |
1 |
44 |
Paige |
-36.55 |
0.44 |
0.0003 |
210.0 |
True |
18434 |
21 |
L |
G12 |
1 |
45 |
Paige |
-36.76 |
0.41 |
0.0005 |
180.3 |
True |
18434 |
21 |
L |
G12 |
1 |
46 |
Paige |
-36.50 |
0.46 |
0.0007 |
190.0 |
True |
18434 |
21 |
L |
G12 |
1 |
47 |
Paige |
-36.69 |
0.42 |
0.0003 |
250.5 |
True |
18434 |
21 |
L |
G12 |
1 |
48 |
Paige |
-36.69 |
0.35 |
0.0001 |
270.0 |
True |
18434 |
21 |
L |
G12 |
1 |
49 |
Paige |
-36.61 |
0.40 |
0.0002 |
250.0 |
True |