## |
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 |
|
C |
31 |
7 |
2048 |
◊ |
A |
x,y,z |
1_555 |
32 |
7 |
2054 |
285.2 |
-8.3 |
0.385 |
10 |
0 |
0 |
0.084 |
2 |
2 |
|
[KSB]C:101 |
34 |
1 |
811 |
◊ |
A |
x,y,z |
1_555 |
40 |
5 |
2054 |
247.9 |
4.6 |
0.726 |
0 |
0 |
0 |
0.000 |
3 |
|
[KSB]A:101 |
33 |
1 |
804 |
◊ |
C |
x,y,z |
1_555 |
41 |
4 |
2048 |
246.3 |
4.7 |
0.725 |
0 |
0 |
0 |
0.000 |
Average: |
247.1 |
4.6 |
0.725 |
0 |
0 |
0 |
0.000 |
3 |
4 |
|
[KSB]B:101 |
33 |
1 |
811 |
◊ |
D |
x,y,z |
1_555 |
38 |
3 |
2293 |
238.6 |
5.2 |
0.702 |
0 |
0 |
0 |
0.000 |
5 |
|
[KSB]D:101 |
35 |
1 |
811 |
◊ |
B |
x,y,z |
1_555 |
38 |
3 |
2135 |
235.6 |
5.3 |
0.709 |
0 |
0 |
0 |
0.000 |
Average: |
237.1 |
5.2 |
0.706 |
0 |
0 |
0 |
0.000 |
4 |
6 |
|
B |
31 |
7 |
2135 |
◊ |
C |
x,y,z |
1_555 |
31 |
7 |
2048 |
227.7 |
-6.0 |
0.518 |
3 |
0 |
0 |
0.589 |
7 |
|
D |
29 |
7 |
2293 |
◊ |
A |
x,y,z |
1_555 |
27 |
7 |
2054 |
211.3 |
-4.6 |
0.506 |
3 |
0 |
0 |
0.589 |
Average: |
219.5 |
-5.3 |
0.512 |
3 |
0 |
0 |
0.589 |
5 |
8 |
|
D |
25 |
6 |
2293 |
◊ |
B |
x,y,z |
1_555 |
24 |
6 |
2135 |
220.0 |
-3.7 |
0.505 |
5 |
0 |
0 |
0.043 |
6 |
9 |
|
[KSB]A:101 |
31 |
1 |
804 |
◊ |
A |
x,y,z |
1_555 |
32 |
4 |
2054 |
187.0 |
0.1 |
0.459 |
0 |
0 |
0 |
0.000 |
10 |
|
[KSB]C:101 |
28 |
1 |
811 |
◊ |
C |
x,y,z |
1_555 |
29 |
4 |
2048 |
174.4 |
0.0 |
0.447 |
0 |
0 |
0 |
0.000 |
Average: |
180.7 |
0.1 |
0.453 |
0 |
0 |
0 |
0.000 |
7 |
11 |
|
[QHL]C:102 |
29 |
1 |
827 |
◊ |
[QHL]A:102 |
x,y,z |
1_555 |
29 |
1 |
831 |
184.3 |
2.6 |
0.463 |
0 |
0 |
0 |
0.000 |
8 |
12 |
|
[KSB]D:101 |
26 |
1 |
811 |
◊ |
D |
x,y,z |
1_555 |
28 |
3 |
2293 |
172.6 |
-0.1 |
0.402 |
0 |
0 |
0 |
0.000 |
13 |
|
[KSB]B:101 |
23 |
1 |
811 |
◊ |
B |
x,y,z |
1_555 |
26 |
4 |
2135 |
166.0 |
0.1 |
0.418 |
0 |
0 |
0 |
0.000 |
Average: |
169.3 |
0.0 |
0.410 |
0 |
0 |
0 |
0.000 |
9 |
14 |
|
[QHL]C:102 |
18 |
1 |
827 |
f |
C |
x,y,z |
1_555 |
17 |
3 |
2048 |
123.8 |
-3.2 |
0.280 |
0 |
0 |
0 |
0.261 |
15 |
|
A |
16 |
3 |
2054 |
f |
[QHL]A:102 |
x-1,y-1,z |
1_445 |
17 |
1 |
831 |
119.9 |
-2.6 |
0.306 |
0 |
0 |
0 |
0.261 |
Average: |
121.9 |
-2.9 |
0.293 |
0 |
0 |
0 |
0.261 |
10 |
16 |
|
C |
13 |
2 |
2048 |
◊ |
[QHL]A:102 |
x-1,y-1,z |
1_445 |
19 |
1 |
831 |
107.1 |
0.0 |
0.502 |
0 |
0 |
0 |
0.000 |
17 |
|
[QHL]C:102 |
19 |
1 |
827 |
◊ |
A |
x,y,z |
1_555 |
13 |
2 |
2054 |
105.6 |
0.0 |
0.504 |
0 |
0 |
0 |
0.000 |
Average: |
106.4 |
0.0 |
0.503 |
0 |
0 |
0 |
0.000 |
11 |
18 |
|
[KSB]C:101 |
14 |
1 |
811 |
◊ |
[KSB]D:101 |
x-y+1,x,z-1/6 |
2_654 |
14 |
1 |
811 |
106.3 |
-1.9 |
0.147 |
0 |
0 |
0 |
0.000 |
19 |
|
[KSB]B:101 |
14 |
1 |
811 |
◊ |
[KSB]A:101 |
x-y,x,z-1/6 |
2_554 |
14 |
1 |
804 |
104.9 |
-2.0 |
0.149 |
0 |
0 |
0 |
0.000 |
Average: |
105.6 |
-2.0 |
0.148 |
0 |
0 |
0 |
0.000 |
12 |
20 |
|
D |
18 |
2 |
2293 |
◊ |
[QHL]A:102 |
x-1,y-1,z |
1_445 |
10 |
1 |
831 |
102.1 |
-1.8 |
0.279 |
0 |
0 |
0 |
0.149 |
21 |
|
[QHL]C:102 |
10 |
1 |
827 |
◊ |
B |
x,y,z |
1_555 |
18 |
2 |
2135 |
100.0 |
-1.8 |
0.285 |
0 |
0 |
0 |
0.149 |
Average: |
101.1 |
-1.8 |
0.282 |
0 |
0 |
0 |
0.149 |
13 |
22 |
|
B |
14 |
2 |
2135 |
◊ |
D |
x-1,y-1,z |
1_445 |
13 |
1 |
2293 |
100.7 |
1.6 |
0.707 |
1 |
0 |
0 |
0.000 |
14 |
23 |
|
[QHL]A:102 |
12 |
1 |
831 |
◊ |
A |
x,y,z |
1_555 |
15 |
2 |
2054 |
95.9 |
1.5 |
0.700 |
0 |
0 |
0 |
0.000 |
24 |
|
C |
14 |
2 |
2048 |
◊ |
[QHL]C:102 |
x-1,y-1,z |
1_445 |
11 |
1 |
827 |
93.9 |
1.6 |
0.719 |
0 |
0 |
0 |
0.000 |
Average: |
94.9 |
1.6 |
0.710 |
0 |
0 |
0 |
0.000 |
15 |
25 |
|
B |
11 |
4 |
2135 |
◊ |
A |
x,y,z |
1_555 |
10 |
5 |
2054 |
83.9 |
-1.2 |
0.563 |
0 |
0 |
0 |
0.007 |
26 |
|
D |
9 |
4 |
2293 |
◊ |
C |
x,y,z |
1_555 |
10 |
5 |
2048 |
78.9 |
-0.6 |
0.580 |
0 |
0 |
0 |
0.007 |
Average: |
81.4 |
-0.9 |
0.571 |
0 |
0 |
0 |
0.007 |
16 |
27 |
|
D |
11 |
2 |
2293 |
◊ |
[QHL]C:102 |
x-y,x-1,z-1/6 |
2_544 |
9 |
1 |
827 |
83.0 |
-0.7 |
0.468 |
0 |
0 |
0 |
0.000 |
28 |
|
[QHL]A:102 |
10 |
1 |
831 |
◊ |
B |
x-y+1,x,z-1/6 |
2_654 |
11 |
2 |
2135 |
74.3 |
0.8 |
0.620 |
0 |
0 |
0 |
0.000 |
Average: |
78.7 |
0.1 |
0.544 |
0 |
0 |
0 |
0.000 |
17 |
29 |
|
[KSB]D:101 |
5 |
1 |
811 |
◊ |
A |
x,y,z |
1_555 |
16 |
2 |
2054 |
77.7 |
1.3 |
0.619 |
0 |
0 |
0 |
0.000 |
30 |
|
[KSB]B:101 |
5 |
1 |
811 |
◊ |
C |
x,y,z |
1_555 |
15 |
2 |
2048 |
77.3 |
1.2 |
0.614 |
0 |
0 |
0 |
0.000 |
Average: |
77.5 |
1.3 |
0.617 |
0 |
0 |
0 |
0.000 |
18 |
31 |
|
D |
12 |
2 |
2293 |
◊ |
B |
x-y,x-1,z-1/6 |
2_544 |
10 |
2 |
2135 |
77.6 |
-0.2 |
0.597 |
0 |
0 |
0 |
0.000 |
19 |
32 |
|
[KSB]C:101 |
5 |
1 |
811 |
◊ |
B |
x,y,z |
1_555 |
15 |
2 |
2135 |
70.8 |
1.1 |
0.611 |
0 |
0 |
0 |
0.000 |
33 |
|
[KSB]A:101 |
5 |
1 |
804 |
◊ |
D |
x,y,z |
1_555 |
16 |
2 |
2293 |
69.9 |
1.1 |
0.602 |
0 |
0 |
0 |
0.000 |
Average: |
70.4 |
1.1 |
0.607 |
0 |
0 |
0 |
0.000 |
20 |
34 |
|
[KSB]D:101 |
6 |
1 |
811 |
f |
[KSB]C:101 |
x,y,z |
1_555 |
6 |
1 |
811 |
64.6 |
1.7 |
0.694 |
0 |
0 |
0 |
0.000 |
35 |
|
[KSB]B:101 |
6 |
1 |
811 |
f |
[KSB]A:101 |
x,y,z |
1_555 |
6 |
1 |
804 |
63.9 |
1.7 |
0.695 |
0 |
0 |
0 |
0.000 |
Average: |
64.2 |
1.7 |
0.694 |
0 |
0 |
0 |
0.000 |
21 |
36 |
|
A |
9 |
2 |
2054 |
◊ |
[KSB]D:101 |
x-y+1,x,z-1/6 |
2_654 |
6 |
1 |
811 |
60.5 |
-0.7 |
0.491 |
0 |
0 |
0 |
0.000 |
37 |
|
[KSB]B:101 |
6 |
1 |
811 |
◊ |
C |
x-y,x,z-1/6 |
2_554 |
10 |
2 |
2048 |
59.0 |
-0.5 |
0.521 |
0 |
0 |
0 |
0.000 |
Average: |
59.8 |
-0.6 |
0.506 |
0 |
0 |
0 |
0.000 |
22 |
38 |
|
[K]A:104 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
10 |
3 |
2054 |
52.7 |
-21.7 |
0.000 |
0 |
0 |
0 |
0.286 |
39 |
|
[K]A:103 |
1 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
11 |
3 |
2048 |
50.8 |
-21.7 |
0.000 |
0 |
0 |
0 |
0.286 |
Average: |
51.7 |
-21.7 |
0.000 |
0 |
0 |
0 |
0.286 |
23 |
40 |
|
[K]A:104 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
9 |
3 |
2135 |
52.4 |
-22.4 |
0.000 |
0 |
0 |
0 |
0.315 |
41 |
|
[K]A:103 |
1 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
10 |
3 |
2293 |
50.6 |
-21.1 |
0.000 |
0 |
0 |
0 |
0.315 |
Average: |
51.5 |
-21.7 |
0.000 |
0 |
0 |
0 |
0.315 |
24 |
42 |
|
[K]A:104 |
1 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
11 |
3 |
2048 |
50.3 |
-22.3 |
0.000 |
0 |
0 |
0 |
0.293 |
43 |
|
[K]A:103 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
10 |
3 |
2054 |
50.2 |
-22.1 |
0.000 |
0 |
0 |
0 |
0.293 |
Average: |
50.3 |
-22.2 |
0.000 |
0 |
0 |
0 |
0.293 |
25 |
44 |
|
[K]A:103 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
2135 |
48.4 |
-21.2 |
0.000 |
0 |
0 |
0 |
0.303 |
45 |
|
[K]A:104 |
1 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
8 |
3 |
2293 |
47.2 |
-20.6 |
0.000 |
0 |
0 |
0 |
0.303 |
Average: |
47.8 |
-20.9 |
0.000 |
0 |
0 |
0 |
0.303 |
26 |
46 |
|
[KSB]C:101 |
5 |
1 |
811 |
◊ |
B |
x-y+1,x,z-1/6 |
2_654 |
10 |
3 |
2135 |
46.5 |
-0.3 |
0.560 |
0 |
0 |
0 |
0.000 |
47 |
|
D |
8 |
2 |
2293 |
◊ |
[KSB]A:101 |
x-y,x,z-1/6 |
2_554 |
5 |
1 |
804 |
32.6 |
-0.3 |
0.485 |
0 |
0 |
0 |
0.000 |
Average: |
39.5 |
-0.3 |
0.523 |
0 |
0 |
0 |
0.000 |
27 |
48 |
|
[QHL]A:102 |
3 |
1 |
831 |
◊ |
[QHL]C:102 |
x-y+1,x,z-1/6 |
2_654 |
3 |
1 |
827 |
31.5 |
-0.6 |
0.314 |
0 |
0 |
0 |
0.000 |
28 |
49 |
|
[KSB]A:101 |
4 |
1 |
804 |
◊ |
[QHL]A:102 |
x-1,y-1,z |
1_445 |
5 |
1 |
831 |
31.4 |
0.7 |
0.546 |
0 |
0 |
0 |
0.000 |
50 |
|
[QHL]C:102 |
5 |
1 |
827 |
◊ |
[KSB]C:101 |
x,y,z |
1_555 |
3 |
1 |
811 |
29.4 |
0.7 |
0.566 |
0 |
0 |
0 |
0.000 |
Average: |
30.4 |
0.7 |
0.556 |
0 |
0 |
0 |
0.000 |
29 |
51 |
|
[QHL]A:102 |
4 |
1 |
831 |
◊ |
[KSB]C:101 |
x,y,z |
1_555 |
4 |
1 |
811 |
30.9 |
1.7 |
0.760 |
0 |
0 |
0 |
0.000 |
52 |
|
[KSB]A:101 |
4 |
1 |
804 |
◊ |
[QHL]C:102 |
x-1,y-1,z |
1_445 |
4 |
1 |
827 |
29.0 |
1.6 |
0.744 |
0 |
0 |
0 |
0.000 |
Average: |
30.0 |
1.6 |
0.752 |
0 |
0 |
0 |
0.000 |
30 |
53 |
|
D |
5 |
1 |
2293 |
◊ |
C |
x-y,x-1,z-1/6 |
2_544 |
4 |
2 |
2048 |
30.8 |
-1.1 |
0.432 |
0 |
0 |
0 |
0.000 |
54 |
|
A |
1 |
1 |
2054 |
◊ |
B |
x-y,x-1,z-1/6 |
2_544 |
2 |
1 |
2135 |
3.9 |
0.0 |
0.447 |
0 |
0 |
0 |
0.000 |
Average: |
17.4 |
-0.5 |
0.440 |
0 |
0 |
0 |
0.000 |
31 |
55 |
|
[K]A:104 |
1 |
1 |
216 |
f |
[K]A:103 |
x,y,z |
1_555 |
1 |
1 |
216 |
29.3 |
-29.3 |
0.000 |
0 |
0 |
0 |
0.212 |
32 |
56 |
|
[K]A:103 |
1 |
1 |
216 |
f |
[KSB]C:101 |
x,y,z |
1_555 |
7 |
1 |
811 |
24.1 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.241 |
57 |
|
[K]A:104 |
1 |
1 |
216 |
f |
[KSB]A:101 |
x,y,z |
1_555 |
7 |
1 |
804 |
23.1 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.241 |
58 |
|
[K]A:103 |
1 |
1 |
216 |
f |
[KSB]D:101 |
x,y,z |
1_555 |
7 |
1 |
811 |
22.7 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.241 |
59 |
|
[K]A:104 |
1 |
1 |
216 |
f |
[KSB]B:101 |
x,y,z |
1_555 |
7 |
1 |
811 |
22.2 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.241 |
Average: |
23.0 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.241 |
33 |
60 |
|
[QHL]C:102 |
1 |
1 |
827 |
◊ |
B |
x-y+1,x,z-1/6 |
2_654 |
3 |
1 |
2135 |
21.2 |
0.4 |
0.633 |
0 |
0 |
0 |
0.000 |
61 |
|
D |
4 |
1 |
2293 |
◊ |
[QHL]A:102 |
x-y,x-1,z-1/6 |
2_544 |
1 |
1 |
831 |
14.0 |
0.1 |
0.604 |
0 |
0 |
0 |
0.000 |
Average: |
17.6 |
0.2 |
0.619 |
0 |
0 |
0 |
0.000 |
34 |
62 |
|
[KSB]B:101 |
2 |
1 |
811 |
◊ |
[QHL]A:102 |
x-1,y-1,z |
1_445 |
2 |
1 |
831 |
19.7 |
0.3 |
0.481 |
0 |
0 |
0 |
0.000 |
63 |
|
[QHL]C:102 |
2 |
1 |
827 |
◊ |
[KSB]D:101 |
x,y,z |
1_555 |
2 |
1 |
811 |
19.4 |
0.3 |
0.470 |
0 |
0 |
0 |
0.000 |
Average: |
19.6 |
0.3 |
0.476 |
0 |
0 |
0 |
0.000 |
35 |
64 |
|
C |
3 |
2 |
2048 |
◊ |
D |
x-1,y-1,z |
1_445 |
3 |
1 |
2293 |
14.2 |
0.2 |
0.498 |
0 |
0 |
0 |
0.000 |
36 |
65 |
|
C |
1 |
1 |
2048 |
◊ |
A |
x-1,y-1,z |
1_445 |
2 |
1 |
2054 |
12.9 |
0.6 |
0.711 |
0 |
0 |
0 |
0.000 |
37 |
66 |
|
B |
6 |
2 |
2135 |
◊ |
C |
x-1,y,z |
1_455 |
1 |
1 |
2048 |
10.9 |
-0.6 |
0.322 |
0 |
0 |
0 |
0.000 |
67 |
|
A |
1 |
1 |
2054 |
◊ |
D |
x,y-1,z |
1_545 |
3 |
2 |
2293 |
5.4 |
-0.5 |
0.269 |
0 |
0 |
0 |
0.000 |
Average: |
8.1 |
-0.5 |
0.295 |
0 |
0 |
0 |
0.000 |
38 |
68 |
|
[QHL]A:102 |
3 |
1 |
831 |
◊ |
C |
x,y,z |
1_555 |
2 |
2 |
2048 |
4.2 |
-0.1 |
0.412 |
0 |
0 |
0 |
0.000 |
69 |
|
A |
1 |
1 |
2054 |
◊ |
[QHL]C:102 |
x-1,y-1,z |
1_445 |
1 |
1 |
827 |
1.3 |
0.0 |
0.472 |
0 |
0 |
0 |
0.000 |
Average: |
2.7 |
-0.0 |
0.442 |
0 |
0 |
0 |
0.000 |
39 |
70 |
|
A |
3 |
2 |
2054 |
◊ |
C |
x-1,y-1,z |
1_445 |
1 |
1 |
2048 |
3.9 |
-0.2 |
0.298 |
0 |
0 |
0 |
0.000 |
40 |
71 |
|
[KSB]C:101 |
1 |
1 |
811 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
2293 |
2.2 |
-0.2 |
0.344 |
0 |
0 |
0 |
0.002 |
72 |
|
[KSB]A:101 |
1 |
1 |
804 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
2135 |
1.2 |
-0.1 |
0.355 |
0 |
0 |
0 |
0.002 |
Average: |
1.7 |
-0.1 |
0.349 |
0 |
0 |
0 |
0.002 |
|