| 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 | 66 | RL_12 | G12 | 2 | 0 | Paige | 6.42 | 0.0 | 9.12 | 4.34 | -21.83 | 4.37 | -9.48 | 1.90 | 0.0155 | 360.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 1 | Paige | 6.42 | 0.0 | 7.31 | 4.36 | -23.76 | 4.38 | -10.32 | 1.90 | 0.0193 | 360.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 2 | Paige | 6.42 | 0.0 | 7.07 | 4.26 | -23.96 | 4.29 | -10.41 | 1.86 | 0.0155 | 430.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 3 | Paige | 6.42 | 0.0 | 7.57 | 4.09 | -23.33 | 4.11 | -10.13 | 1.78 | 0.0193 | 230.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 4 | Paige | 6.42 | 0.0 | 7.46 | 4.05 | -23.47 | 4.07 | -10.19 | 1.77 | 0.0124 | 380.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 5 | Paige | 6.42 | 0.0 | 6.93 | 4.75 | -24.10 | 4.77 | -10.47 | 2.07 | 0.0242 | 160.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 6 | Paige | 6.42 | 0.0 | 6.32 | 3.94 | -24.78 | 3.98 | -10.76 | 1.73 | 0.0193 | 330.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 7 | Paige | 6.42 | 0.0 | 8.14 | 3.91 | -22.90 | 3.94 | -9.95 | 1.71 | 0.0124 | 390.55 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 8 | Paige | 6.42 | 0.0 | 7.83 | 3.66 | -23.16 | 3.69 | -10.06 | 1.60 | 0.0193 | 160.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 9 | Paige | 6.42 | 0.0 | 8.48 | 5.01 | -22.55 | 5.03 | -9.79 | 2.18 | 0.0193 | 270.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 10 | Paige | 6.42 | 0.0 | 7.26 | 5.14 | -23.73 | 5.16 | -10.31 | 2.24 | 0.0242 | 330.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 11 | Paige | 6.42 | 0.0 | 7.26 | 4.41 | -23.77 | 4.43 | -10.32 | 1.92 | 0.0193 | 230.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 12 | Paige | 6.42 | 0.0 | 8.29 | 4.28 | -22.97 | 4.32 | -9.98 | 1.88 | 0.0242 | 210.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 13 | Paige | 6.42 | 0.0 | 7.19 | 5.10 | -23.77 | 5.11 | -10.33 | 2.22 | 0.0193 | 270.2 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 14 | Paige | 6.42 | 0.0 | 7.39 | 3.95 | -23.70 | 4.01 | -10.29 | 1.74 | 0.0155 | 290.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 15 | Paige | 6.42 | 0.0 | 7.41 | 4.70 | -23.56 | 4.72 | -10.23 | 2.05 | 0.0193 | 370.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 16 | Paige | 6.42 | 0.0 | 6.85 | 4.67 | -24.13 | 4.67 | -10.48 | 2.03 | 0.0242 | 240.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 17 | Paige | 6.42 | 0.0 | 7.72 | 4.31 | -23.34 | 4.32 | -10.14 | 1.88 | 0.0099 | 390.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 18 | Paige | 6.42 | 0.0 | 9.57 | 5.95 | -21.54 | 5.96 | -9.35 | 2.59 | 0.0193 | 220.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 19 | Paige | 6.42 | 0.0 | 7.15 | 3.29 | -23.84 | 3.31 | -10.35 | 1.44 | 0.0155 | 350.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 20 | Paige | 6.42 | 0.0 | 8.37 | 4.09 | -22.71 | 4.11 | -9.86 | 1.79 | 0.0155 | 360.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 21 | Paige | 6.42 | 0.0 | 8.90 | 5.64 | -22.08 | 5.65 | -9.59 | 2.45 | 0.0193 | 240.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 22 | Paige | 6.42 | 0.0 | 7.92 | 5.06 | -23.10 | 5.08 | -10.03 | 2.21 | 0.0193 | 430.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 23 | Paige | 6.42 | 0.0 | 6.97 | 4.48 | -24.11 | 4.50 | -10.47 | 1.95 | 0.0193 | 250.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 24 | Paige | 6.42 | 0.0 | 7.19 | 4.32 | -23.77 | 4.35 | -10.32 | 1.89 | 0.0193 | 220.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 25 | Paige | 6.42 | 0.0 | 8.55 | 5.80 | -22.49 | 5.81 | -9.77 | 2.52 | 0.0193 | 320.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 26 | Paige | 6.42 | 0.0 | 8.08 | 4.48 | -23.12 | 4.51 | -10.04 | 1.96 | 0.0155 | 410.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 27 | Paige | 6.42 | 0.0 | 8.13 | 3.92 | -22.76 | 3.93 | -9.88 | 1.71 | 0.0124 | 410.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 28 | Paige | 6.42 | 0.0 | 7.68 | 3.66 | -23.25 | 3.68 | -10.10 | 1.60 | 0.0124 | 250.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 29 | Paige | 6.42 | 0.0 | 7.33 | 3.54 | -23.71 | 3.57 | -10.30 | 1.55 | 0.0193 | 240.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 30 | Paige | 6.42 | 0.0 | 8.45 | 4.85 | -22.60 | 4.86 | -9.82 | 2.11 | 0.0193 | 200.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 31 | Paige | 6.42 | 0.0 | 7.00 | 4.31 | -24.05 | 4.33 | -10.45 | 1.88 | 0.0155 | 340.3 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 32 | Paige | 6.42 | 0.0 | 7.16 | 4.39 | -24.08 | 4.40 | -10.46 | 1.91 | 0.0155 | 360.25 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 33 | Paige | 6.42 | 0.0 | 6.85 | 4.28 | -24.05 | 4.30 | -10.44 | 1.87 | 0.0302 | 200.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 34 | Paige | 6.42 | 0.0 | 7.64 | 4.03 | -23.50 | 4.04 | -10.21 | 1.75 | 0.0124 | 310.4 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 35 | Paige | 6.42 | 0.0 | 7.97 | 5.09 | -23.06 | 5.11 | -10.01 | 2.22 | 0.0193 | 230.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 36 | Paige | 6.42 | 0.0 | 10.11 | 6.85 | -20.80 | 6.87 | -9.03 | 2.98 | 0.0302 | 220.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 37 | Paige | 6.42 | 0.0 | 8.13 | 4.70 | -22.87 | 4.72 | -9.93 | 2.05 | 0.0193 | 270.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 38 | Paige | 6.42 | 0.0 | 9.34 | 5.46 | -21.92 | 5.48 | -9.52 | 2.38 | 0.0242 | 220.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 39 | Paige | 6.42 | 0.0 | 6.96 | 4.57 | -23.96 | 4.59 | -10.40 | 1.99 | 0.0242 | 270.2 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 40 | Paige | 6.42 | 0.0 | 7.82 | 3.85 | -23.34 | 3.88 | -10.13 | 1.68 | 0.0242 | 300.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 41 | Paige | 6.42 | 0.0 | 8.20 | 5.03 | -22.86 | 5.05 | -9.93 | 2.19 | 0.0242 | 200.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 42 | Paige | 6.42 | 0.0 | 7.90 | 4.33 | -23.12 | 4.34 | -10.04 | 1.89 | 0.0099 | 470.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 43 | Paige | 6.42 | 0.0 | 7.46 | 3.96 | -23.64 | 3.98 | -10.27 | 1.73 | 0.0193 | 340.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 44 | Paige | 6.42 | 0.0 | 8.37 | 4.01 | -22.67 | 4.05 | -9.84 | 1.76 | 0.0124 | 290.1 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 45 | Paige | 6.42 | 0.0 | 8.23 | 6.20 | -22.88 | 6.22 | -9.94 | 2.70 | 0.0242 | 300.1 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 46 | Paige | 6.42 | 0.0 | 6.76 | 4.45 | -24.30 | 4.47 | -10.56 | 1.94 | 0.0193 | 250.3 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 47 | Paige | 6.42 | 0.0 | 7.48 | 4.22 | -23.65 | 4.23 | -10.27 | 1.84 | 0.0155 | 330.1 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 48 | Paige | 6.42 | 0.0 | 7.10 | 3.49 | -24.08 | 3.54 | -10.46 | 1.54 | 0.0193 | 260.0 | True |
| 18433 | 66 | RL_12 | G12 | 2 | 49 | Paige | 6.42 | 0.0 | 6.76 | 4.22 | -24.16 | 4.26 | -10.49 | 1.85 | 0.0302 | 100.0 | True |
| Project | RUN | System | Guest | Microstate | CLONE | Person | dG2 (kT) | dG2 sigma (kT) | L WL-increment | ns of L simulation | Included |
|---|---|---|---|---|---|---|---|---|---|---|---|
| 18434 | 22 | L | G12 | 2 | 0 | Paige | -37.37 | 0.43 | 0.0003 | 260.0 | True |
| 18434 | 22 | L | G12 | 2 | 1 | Paige | -37.48 | 0.44 | 0.0026 | 100.0 | True |
| 18434 | 22 | L | G12 | 2 | 2 | Paige | -37.45 | 0.46 | 0.0004 | 220.0 | True |
| 18434 | 22 | L | G12 | 2 | 3 | Paige | -37.31 | 0.35 | 0.0001 | 260.05 | True |
| 18434 | 22 | L | G12 | 2 | 4 | Paige | -37.34 | 0.34 | 0.0001 | 280.0 | True |
| 18434 | 22 | L | G12 | 2 | 5 | Paige | -37.45 | 0.49 | 0.0011 | 160.0 | True |
| 18434 | 22 | L | G12 | 2 | 6 | Paige | -37.52 | 0.56 | 0.0005 | 180.25 | True |
| 18434 | 22 | L | G12 | 2 | 7 | Paige | -37.46 | 0.48 | 0.0007 | 190.0 | True |
| 18434 | 22 | L | G12 | 2 | 8 | Paige | -37.40 | 0.48 | 0.0011 | 230.05 | True |
| 18434 | 22 | L | G12 | 2 | 9 | Paige | -37.44 | 0.39 | 0.0003 | 250.1 | True |
| 18434 | 22 | L | G12 | 2 | 10 | Paige | -37.41 | 0.46 | 0.0011 | 170.05 | True |
| 18434 | 22 | L | G12 | 2 | 11 | Paige | -37.45 | 0.37 | 0.0005 | 230.0 | True |
| 18434 | 22 | L | G12 | 2 | 12 | Paige | -37.67 | 0.58 | 0.0026 | 170.1 | True |
| 18434 | 22 | L | G12 | 2 | 13 | Paige | -37.38 | 0.37 | 0.0007 | 220.0 | True |
| 18434 | 22 | L | G12 | 2 | 14 | Paige | -37.51 | 0.67 | 0.0026 | 130.0 | True |
| 18434 | 22 | L | G12 | 2 | 15 | Paige | -37.39 | 0.46 | 0.0007 | 190.0 | True |
| 18434 | 22 | L | G12 | 2 | 16 | Paige | -37.39 | 0.26 | 0.0001 | 280.25 | True |
| 18434 | 22 | L | G12 | 2 | 17 | Paige | -37.48 | 0.35 | 0.0005 | 230.15 | True |
| 18434 | 22 | L | G12 | 2 | 18 | Paige | -37.52 | 0.44 | 0.0011 | 160.0 | True |
| 18434 | 22 | L | G12 | 2 | 19 | Paige | -37.40 | 0.39 | 0.0001 | 250.1 | True |
| 18434 | 22 | L | G12 | 2 | 20 | Paige | -37.50 | 0.40 | 0.0004 | 220.1 | True |
| 18434 | 22 | L | G12 | 2 | 21 | Paige | -37.39 | 0.34 | 0.0002 | 240.0 | True |
| 18434 | 22 | L | G12 | 2 | 22 | Paige | -37.43 | 0.47 | 0.0013 | 140.0 | True |
| 18434 | 22 | L | G12 | 2 | 23 | Paige | -37.50 | 0.43 | 0.0009 | 180.05 | True |
| 18434 | 22 | L | G12 | 2 | 24 | Paige | -37.37 | 0.43 | 0.0009 | 190.0 | True |
| 18434 | 22 | L | G12 | 2 | 25 | Paige | -37.46 | 0.36 | 0.0003 | 240.0 | True |
| 18434 | 22 | L | G12 | 2 | 26 | Paige | -37.62 | 0.44 | 0.0013 | 170.0 | True |
| 18434 | 22 | L | G12 | 2 | 27 | Paige | -37.30 | 0.32 | 0.0002 | 270.0 | True |
| 18434 | 22 | L | G12 | 2 | 28 | Paige | -37.34 | 0.44 | 0.0005 | 220.0 | True |
| 18434 | 22 | L | G12 | 2 | 29 | Paige | -37.46 | 0.43 | 0.0007 | 260.0 | True |
| 18434 | 22 | L | G12 | 2 | 30 | Paige | -37.46 | 0.32 | 0.0003 | 240.15 | True |
| 18434 | 22 | L | G12 | 2 | 31 | Paige | -37.47 | 0.40 | 0.0009 | 190.1 | True |
| 18434 | 22 | L | G12 | 2 | 32 | Paige | -37.66 | 0.31 | 0.0002 | 220.0 | True |
| 18434 | 22 | L | G12 | 2 | 33 | Paige | -37.31 | 0.47 | 0.0011 | 200.0 | True |
| 18434 | 22 | L | G12 | 2 | 34 | Paige | -37.55 | 0.28 | 0.0013 | 170.0 | True |
| 18434 | 22 | L | G12 | 2 | 35 | Paige | -37.44 | 0.36 | 0.0002 | 280.0 | True |
| 18434 | 22 | L | G12 | 2 | 36 | Paige | -37.32 | 0.49 | 0.0011 | 160.35 | True |
| 18434 | 22 | L | G12 | 2 | 37 | Paige | -37.42 | 0.40 | 0.0005 | 210.0 | True |
| 18434 | 22 | L | G12 | 2 | 38 | Paige | -37.67 | 0.44 | 0.0017 | 180.0 | True |
| 18434 | 22 | L | G12 | 2 | 39 | Paige | -37.34 | 0.43 | 0.0009 | 180.15 | True |
| 18434 | 22 | L | G12 | 2 | 40 | Paige | -37.57 | 0.47 | 0.0021 | 120.0 | True |
| 18434 | 22 | L | G12 | 2 | 41 | Paige | -37.48 | 0.41 | 0.0003 | 300.1 | True |
| 18434 | 22 | L | G12 | 2 | 42 | Paige | -37.43 | 0.34 | 0.0001 | 270.7 | True |
| 18434 | 22 | L | G12 | 2 | 43 | Paige | -37.51 | 0.37 | 0.0009 | 200.0 | True |
| 18434 | 22 | L | G12 | 2 | 44 | Paige | -37.45 | 0.62 | 0.0026 | 120.35 | True |
| 18434 | 22 | L | G12 | 2 | 45 | Paige | -37.52 | 0.49 | 0.0026 | 140.0 | True |
| 18434 | 22 | L | G12 | 2 | 46 | Paige | -37.48 | 0.41 | 0.0004 | 200.25 | True |
| 18434 | 22 | L | G12 | 2 | 47 | Paige | -37.55 | 0.38 | 0.0003 | 210.0 | True |
| 18434 | 22 | L | G12 | 2 | 48 | Paige | -37.59 | 0.62 | 0.0051 | 90.0 | True |
| 18434 | 22 | L | G12 | 2 | 49 | Paige | -37.33 | 0.57 | 0.0026 | 120.1 | True |