| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
| 1 |
1 |
|
B |
234 |
68 |
14660 |
◊ |
A |
x,y,z |
1_555 |
227 |
64 |
14614 |
2294.1 |
-31.7 |
0.034 |
22 |
2 |
0 |
0.057 |
| 2 |
2 |
|
A |
109 |
31 |
14614 |
◊ |
A |
-x+1,-y+1,z |
2_665 |
110 |
31 |
14614 |
1051.2 |
-4.2 |
0.650 |
10 |
2 |
0 |
0.013 |
3 |
|
B |
110 |
31 |
14660 |
◊ |
B |
-x+1,-y+1,z |
2_665 |
110 |
31 |
14660 |
1048.4 |
-5.8 |
0.558 |
10 |
2 |
0 |
0.013 |
| Average: |
1049.8 |
-5.0 |
0.604 |
10 |
2 |
0 |
0.013 |
| 3 |
4 |
|
B |
35 |
13 |
14660 |
◊ |
A |
-x+1,-y+1,z |
2_665 |
38 |
14 |
14614 |
382.4 |
-7.4 |
0.083 |
0 |
0 |
0 |
0.010 |
| 4 |
5 |
|
[AMP]B:339 |
23 |
1 |
467 |
f |
B |
x,y,z |
1_555 |
40 |
17 |
14660 |
312.4 |
-2.8 |
0.528 |
11 |
0 |
0 |
0.021 |
6 |
|
[AMP]A:339 |
23 |
1 |
465 |
f |
A |
x,y,z |
1_555 |
38 |
17 |
14614 |
311.9 |
-2.6 |
0.502 |
11 |
0 |
0 |
0.021 |
| Average: |
312.1 |
-2.7 |
0.515 |
11 |
0 |
0 |
0.021 |
| 5 |
7 |
|
[AHG]B:340 |
19 |
1 |
471 |
f |
B |
x,y,z |
1_555 |
42 |
20 |
14660 |
261.2 |
-0.8 |
0.831 |
12 |
0 |
0 |
0.018 |
8 |
|
[AHG]A:340 |
19 |
1 |
466 |
f |
A |
x,y,z |
1_555 |
44 |
22 |
14614 |
257.4 |
-0.7 |
0.843 |
14 |
0 |
0 |
0.018 |
| Average: |
259.3 |
-0.8 |
0.837 |
13 |
0 |
0 |
0.018 |
| 6 |
9 |
|
B |
23 |
9 |
14660 |
x |
B |
x-1/2,-y+3/2,-z+1 |
4_466 |
27 |
8 |
14660 |
215.3 |
0.6 |
0.753 |
2 |
2 |
0 |
0.000 |
| 7 |
10 |
|
A |
15 |
5 |
14614 |
x |
A |
x-1/2,-y+3/2,-z |
4_465 |
12 |
4 |
14614 |
129.6 |
0.2 |
0.696 |
1 |
1 |
0 |
0.000 |
| 8 |
11 |
|
[K]B:337 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
14 |
8 |
14660 |
91.7 |
-67.8 |
0.000 |
0 |
0 |
0 |
0.187 |
12 |
|
[K]A:336 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
16 |
9 |
14614 |
88.9 |
-67.8 |
0.000 |
0 |
0 |
0 |
0.187 |
| Average: |
90.3 |
-67.8 |
0.000 |
0 |
0 |
0 |
0.187 |
| 9 |
13 |
|
A |
8 |
3 |
14614 |
◊ |
B |
x,y,z-1 |
1_554 |
10 |
3 |
14660 |
89.2 |
-0.1 |
0.633 |
0 |
0 |
0 |
0.000 |
| 10 |
14 |
|
[K]A:338 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
14614 |
87.6 |
-61.7 |
0.000 |
0 |
0 |
0 |
0.170 |
15 |
|
[K]B:338 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
14 |
7 |
14660 |
86.8 |
-61.5 |
0.000 |
0 |
0 |
0 |
0.170 |
| Average: |
87.2 |
-61.6 |
0.000 |
0 |
0 |
0 |
0.170 |
| 11 |
16 |
|
[K]B:336 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
19 |
11 |
14660 |
79.7 |
-52.3 |
0.000 |
0 |
0 |
0 |
0.143 |
17 |
|
[K]A:337 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
20 |
11 |
14614 |
79.1 |
-51.7 |
0.000 |
0 |
0 |
0 |
0.143 |
| Average: |
79.4 |
-52.0 |
0.000 |
0 |
0 |
0 |
0.143 |
| 12 |
18 |
|
[AHG]A:340 |
8 |
1 |
466 |
f |
[K]A:337 |
x,y,z |
1_555 |
1 |
1 |
216 |
46.2 |
-21.9 |
0.000 |
0 |
0 |
0 |
0.060 |
19 |
|
[AHG]B:340 |
8 |
1 |
471 |
f |
[K]B:336 |
x,y,z |
1_555 |
1 |
1 |
216 |
45.7 |
-21.7 |
0.000 |
0 |
0 |
0 |
0.060 |
| Average: |
45.9 |
-21.8 |
0.000 |
0 |
0 |
0 |
0.060 |
| 13 |
20 |
|
[AHG]B:340 |
3 |
1 |
471 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
14614 |
44.1 |
-0.2 |
0.567 |
2 |
0 |
0 |
0.002 |
21 |
|
[AHG]A:340 |
3 |
1 |
466 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
14660 |
42.0 |
-0.1 |
0.627 |
1 |
0 |
0 |
0.002 |
| Average: |
43.0 |
-0.1 |
0.597 |
2 |
0 |
0 |
0.002 |
| 14 |
22 |
|
[K]A:338 |
1 |
1 |
216 |
f |
[K]A:337 |
x,y,z |
1_555 |
1 |
1 |
216 |
40.1 |
-40.1 |
0.000 |
0 |
0 |
0 |
0.055 |
| 15 |
23 |
|
[AHG]B:340 |
9 |
1 |
471 |
f |
[K]B:338 |
x,y,z |
1_555 |
1 |
1 |
216 |
40.0 |
-19.4 |
0.000 |
0 |
0 |
0 |
0.052 |
24 |
|
[AHG]A:340 |
9 |
1 |
466 |
f |
[K]A:338 |
x,y,z |
1_555 |
1 |
1 |
216 |
38.6 |
-18.6 |
0.000 |
0 |
0 |
0 |
0.052 |
| Average: |
39.3 |
-19.0 |
0.000 |
0 |
0 |
0 |
0.052 |
| 16 |
25 |
|
[K]B:338 |
1 |
1 |
216 |
f |
[K]B:336 |
x,y,z |
1_555 |
1 |
1 |
216 |
39.0 |
-39.0 |
0.000 |
0 |
0 |
0 |
0.054 |
| 17 |
26 |
|
[K]B:337 |
1 |
1 |
216 |
f |
[K]B:336 |
x,y,z |
1_555 |
1 |
1 |
216 |
38.1 |
-38.1 |
0.000 |
0 |
0 |
0 |
0.052 |
| 18 |
27 |
|
[K]A:337 |
1 |
1 |
216 |
f |
[K]A:336 |
x,y,z |
1_555 |
1 |
1 |
216 |
37.7 |
-37.7 |
0.000 |
0 |
0 |
0 |
0.052 |
| 19 |
28 |
|
[AHG]A:340 |
3 |
1 |
466 |
f |
[K]A:336 |
x,y,z |
1_555 |
1 |
1 |
216 |
26.3 |
-13.1 |
0.000 |
0 |
0 |
0 |
0.036 |
29 |
|
[AHG]B:340 |
3 |
1 |
471 |
f |
[K]B:337 |
x,y,z |
1_555 |
1 |
1 |
216 |
25.9 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.036 |
| Average: |
26.1 |
-12.9 |
0.000 |
0 |
0 |
0 |
0.036 |
| 20 |
30 |
|
[K]B:338 |
1 |
1 |
216 |
f |
[K]B:337 |
x,y,z |
1_555 |
1 |
1 |
216 |
15.0 |
-15.0 |
0.000 |
0 |
0 |
0 |
0.021 |
| 21 |
31 |
|
[K]A:338 |
1 |
1 |
216 |
f |
[K]A:336 |
x,y,z |
1_555 |
1 |
1 |
216 |
14.7 |
-14.7 |
0.000 |
0 |
0 |
0 |
0.020 |
|