## |
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 |
|
A |
139 |
37 |
5286 |
◊ |
A |
-x,y,-z |
2_555 |
139 |
37 |
5286 |
1376.3 |
-19.8 |
0.187 |
16 |
0 |
0 |
0.885 |
2 |
|
D |
139 |
38 |
5242 |
◊ |
D |
-x,y,-z+1 |
2_556 |
138 |
38 |
5242 |
1360.2 |
-18.0 |
0.218 |
16 |
0 |
0 |
0.885 |
3 |
|
F |
137 |
37 |
5189 |
◊ |
E |
-x,y,-z+1 |
2_556 |
135 |
36 |
5317 |
1343.8 |
-20.2 |
0.141 |
17 |
0 |
0 |
0.885 |
4 |
|
C |
139 |
36 |
5191 |
◊ |
B |
-x,y,-z |
2_555 |
136 |
37 |
5166 |
1334.7 |
-20.9 |
0.172 |
16 |
0 |
0 |
0.885 |
Average: |
1353.7 |
-19.8 |
0.180 |
16 |
0 |
0 |
0.885 |
2 |
5 |
|
B |
56 |
17 |
5166 |
◊ |
A |
-x,y,-z |
2_555 |
53 |
17 |
5286 |
521.8 |
-3.0 |
0.592 |
10 |
7 |
0 |
0.642 |
6 |
|
E |
55 |
17 |
5317 |
◊ |
D |
-x,y,-z+1 |
2_556 |
54 |
18 |
5242 |
514.7 |
-4.5 |
0.457 |
9 |
7 |
0 |
0.642 |
7 |
|
C |
51 |
17 |
5191 |
◊ |
C |
-x,y,-z |
2_555 |
51 |
17 |
5191 |
501.3 |
-2.5 |
0.621 |
10 |
8 |
0 |
0.642 |
8 |
|
F |
50 |
16 |
5189 |
◊ |
F |
-x,y,-z+1 |
2_556 |
52 |
16 |
5189 |
497.8 |
-2.3 |
0.597 |
10 |
8 |
0 |
0.642 |
Average: |
508.9 |
-3.1 |
0.567 |
10 |
8 |
0 |
0.642 |
3 |
9 |
|
C |
57 |
17 |
5191 |
◊ |
A |
x,y,z |
1_555 |
54 |
15 |
5286 |
476.7 |
-6.9 |
0.286 |
5 |
0 |
0 |
0.759 |
10 |
|
F |
57 |
17 |
5189 |
◊ |
D |
x,y,z |
1_555 |
53 |
15 |
5242 |
475.3 |
-6.3 |
0.285 |
6 |
0 |
0 |
0.759 |
11 |
|
E |
51 |
15 |
5317 |
◊ |
D |
x,y,z |
1_555 |
58 |
17 |
5242 |
464.2 |
-6.3 |
0.285 |
5 |
1 |
0 |
0.759 |
12 |
|
B |
51 |
15 |
5166 |
◊ |
A |
x,y,z |
1_555 |
56 |
16 |
5286 |
464.1 |
-6.1 |
0.317 |
6 |
0 |
0 |
0.759 |
13 |
|
F |
50 |
15 |
5189 |
◊ |
E |
x,y,z |
1_555 |
55 |
17 |
5317 |
455.6 |
-5.7 |
0.305 |
4 |
1 |
0 |
0.759 |
14 |
|
C |
45 |
14 |
5191 |
◊ |
B |
x,y,z |
1_555 |
54 |
18 |
5166 |
446.0 |
-6.5 |
0.273 |
4 |
1 |
0 |
0.759 |
Average: |
463.7 |
-6.3 |
0.292 |
5 |
1 |
0 |
0.759 |
4 |
15 |
|
F |
19 |
7 |
5189 |
◊ |
A |
-x,y,-z |
2_555 |
20 |
8 |
5286 |
185.7 |
0.5 |
0.753 |
1 |
3 |
0 |
0.000 |
16 |
|
D |
14 |
6 |
5242 |
◊ |
C |
-x,y,-z |
2_555 |
17 |
6 |
5191 |
135.2 |
0.5 |
0.756 |
1 |
3 |
0 |
0.000 |
Average: |
160.5 |
0.5 |
0.755 |
1 |
3 |
0 |
0.000 |
5 |
17 |
|
A |
21 |
7 |
5286 |
◊ |
B |
x-1/2,y+1/2,z |
3_455 |
22 |
8 |
5166 |
163.7 |
0.2 |
0.615 |
0 |
2 |
0 |
0.000 |
18 |
|
E |
20 |
7 |
5317 |
◊ |
D |
x-1/2,y+1/2,z |
3_455 |
19 |
5 |
5242 |
156.2 |
-1.2 |
0.557 |
0 |
0 |
0 |
0.000 |
Average: |
160.0 |
-0.5 |
0.586 |
0 |
1 |
0 |
0.000 |
6 |
19 |
|
D |
12 |
5 |
5242 |
◊ |
A |
-x,y,-z |
2_555 |
12 |
5 |
5286 |
101.2 |
-1.9 |
0.278 |
0 |
0 |
0 |
0.000 |
7 |
20 |
|
E |
6 |
2 |
5317 |
◊ |
E |
-x-1,y,-z+1 |
2_456 |
6 |
2 |
5317 |
93.6 |
1.6 |
0.878 |
2 |
4 |
0 |
0.000 |
21 |
|
B |
7 |
2 |
5166 |
◊ |
B |
-x+1,y,-z |
2_655 |
7 |
2 |
5166 |
32.6 |
-0.2 |
0.629 |
0 |
0 |
0 |
0.000 |
Average: |
63.1 |
0.7 |
0.754 |
1 |
2 |
0 |
0.000 |
8 |
22 |
|
[MOO]A:1069 |
5 |
1 |
205 |
f |
B |
-x,y,-z |
2_555 |
19 |
6 |
5166 |
83.2 |
-1.4 |
0.638 |
0 |
0 |
0 |
0.100 |
23 |
|
[MOO]D:1069 |
5 |
1 |
204 |
f |
E |
-x,y,-z+1 |
2_556 |
15 |
6 |
5317 |
81.9 |
-1.5 |
0.601 |
0 |
0 |
0 |
0.100 |
24 |
|
[MOO]F:1069 |
5 |
1 |
204 |
f |
F |
-x,y,-z+1 |
2_556 |
15 |
6 |
5189 |
81.1 |
-1.5 |
0.606 |
0 |
0 |
0 |
0.100 |
Average: |
82.1 |
-1.4 |
0.615 |
0 |
0 |
0 |
0.100 |
9 |
25 |
|
[MOO]E:1069 |
5 |
1 |
206 |
f |
D |
-x,y,-z+1 |
2_556 |
16 |
6 |
5242 |
83.0 |
-1.3 |
0.639 |
0 |
0 |
0 |
0.100 |
10 |
26 |
|
[MOO]B:1069 |
5 |
1 |
204 |
f |
A |
-x,y,-z |
2_555 |
17 |
6 |
5286 |
83.0 |
-1.5 |
0.605 |
0 |
0 |
0 |
0.100 |
11 |
27 |
|
[MOO]C:1069 |
5 |
1 |
205 |
f |
C |
-x,y,-z |
2_555 |
16 |
6 |
5191 |
80.3 |
-1.4 |
0.633 |
0 |
0 |
0 |
0.051 |
12 |
28 |
|
B |
9 |
3 |
5166 |
◊ |
A |
-x+1/2,y-1/2,-z |
4_545 |
8 |
3 |
5286 |
70.7 |
-0.2 |
0.598 |
1 |
0 |
0 |
0.000 |
29 |
|
D |
8 |
3 |
5242 |
◊ |
E |
-x-1/2,y-1/2,-z+1 |
4_446 |
8 |
3 |
5317 |
69.7 |
-0.2 |
0.580 |
2 |
0 |
0 |
0.000 |
Average: |
70.2 |
-0.2 |
0.589 |
2 |
0 |
0 |
0.000 |
13 |
30 |
|
[MOO]A:1070 |
4 |
1 |
205 |
f |
C |
x,y,z |
1_555 |
10 |
4 |
5191 |
58.7 |
-1.3 |
0.515 |
0 |
0 |
0 |
0.049 |
14 |
31 |
|
[MOO]A:1070 |
5 |
1 |
205 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
5286 |
57.1 |
-0.9 |
0.595 |
0 |
0 |
0 |
0.027 |
15 |
32 |
|
[MOO]D:1070 |
5 |
1 |
205 |
f |
E |
x,y,z |
1_555 |
10 |
4 |
5317 |
57.0 |
-1.3 |
0.587 |
0 |
0 |
0 |
0.086 |
16 |
33 |
|
[MOO]D:1070 |
5 |
1 |
205 |
◊ |
D |
x,y,z |
1_555 |
10 |
4 |
5242 |
56.7 |
-1.3 |
0.589 |
0 |
0 |
0 |
0.037 |
17 |
34 |
|
[MOO]D:1070 |
5 |
1 |
205 |
◊ |
F |
x,y,z |
1_555 |
10 |
4 |
5189 |
56.6 |
-1.2 |
0.592 |
0 |
0 |
0 |
0.035 |
18 |
35 |
|
D |
8 |
3 |
5242 |
◊ |
F |
x-1/2,y-1/2,z |
3_445 |
6 |
2 |
5189 |
56.2 |
-0.7 |
0.476 |
1 |
0 |
0 |
0.000 |
36 |
|
C |
6 |
3 |
5191 |
◊ |
A |
x-1/2,y-1/2,z |
3_445 |
7 |
3 |
5286 |
55.4 |
-0.6 |
0.526 |
1 |
0 |
0 |
0.000 |
Average: |
55.8 |
-0.6 |
0.501 |
1 |
0 |
0 |
0.000 |
19 |
37 |
|
[MOO]A:1070 |
5 |
1 |
205 |
◊ |
B |
x,y,z |
1_555 |
10 |
4 |
5166 |
55.5 |
-0.9 |
0.610 |
0 |
0 |
0 |
0.026 |
20 |
38 |
|
[MOO]E:1069 |
4 |
1 |
206 |
◊ |
E |
x,y,z |
1_555 |
10 |
4 |
5317 |
50.4 |
-0.8 |
0.616 |
0 |
0 |
0 |
0.056 |
21 |
39 |
|
[MOO]A:1069 |
5 |
1 |
205 |
◊ |
A |
x,y,z |
1_555 |
11 |
4 |
5286 |
49.3 |
-0.6 |
0.677 |
0 |
0 |
0 |
0.031 |
40 |
|
[MOO]D:1069 |
4 |
1 |
204 |
◊ |
D |
x,y,z |
1_555 |
11 |
4 |
5242 |
48.3 |
-0.5 |
0.629 |
0 |
0 |
0 |
0.031 |
Average: |
48.8 |
-0.5 |
0.653 |
0 |
0 |
0 |
0.031 |
22 |
41 |
|
[MOO]C:1069 |
4 |
1 |
205 |
◊ |
C |
x,y,z |
1_555 |
11 |
4 |
5191 |
49.2 |
-0.5 |
0.644 |
0 |
0 |
0 |
0.007 |
23 |
42 |
|
[MOO]F:1069 |
5 |
1 |
204 |
◊ |
F |
x,y,z |
1_555 |
10 |
4 |
5189 |
48.9 |
-0.6 |
0.648 |
0 |
0 |
0 |
0.010 |
24 |
43 |
|
[MOO]B:1069 |
4 |
1 |
204 |
◊ |
B |
x,y,z |
1_555 |
11 |
4 |
5166 |
48.5 |
-0.8 |
0.633 |
0 |
0 |
0 |
0.009 |
25 |
44 |
|
E |
4 |
2 |
5317 |
◊ |
E |
-x,y,-z+1 |
2_556 |
4 |
2 |
5317 |
37.4 |
-1.3 |
0.162 |
0 |
0 |
0 |
0.023 |
45 |
|
B |
3 |
2 |
5166 |
◊ |
B |
-x,y,-z |
2_555 |
3 |
2 |
5166 |
29.5 |
-1.6 |
0.068 |
0 |
0 |
0 |
0.023 |
46 |
|
F |
2 |
1 |
5189 |
◊ |
D |
-x,y,-z+1 |
2_556 |
2 |
1 |
5242 |
28.5 |
-1.5 |
0.036 |
0 |
0 |
0 |
0.023 |
47 |
|
C |
2 |
1 |
5191 |
◊ |
A |
-x,y,-z |
2_555 |
2 |
1 |
5286 |
26.8 |
-1.4 |
0.056 |
0 |
0 |
0 |
0.023 |
Average: |
30.5 |
-1.5 |
0.080 |
0 |
0 |
0 |
0.023 |
26 |
48 |
|
E |
3 |
1 |
5317 |
◊ |
C |
-x,y,-z |
2_555 |
4 |
2 |
5191 |
34.8 |
-1.1 |
0.242 |
0 |
0 |
0 |
0.000 |
49 |
|
F |
3 |
2 |
5189 |
◊ |
B |
-x,y,-z |
2_555 |
3 |
1 |
5166 |
34.3 |
-1.1 |
0.208 |
0 |
0 |
0 |
0.000 |
Average: |
34.6 |
-1.1 |
0.225 |
0 |
0 |
0 |
0.000 |
27 |
50 |
|
E |
5 |
1 |
5317 |
◊ |
F |
x-1/2,y-1/2,z |
3_445 |
3 |
1 |
5189 |
34.6 |
0.3 |
0.726 |
0 |
0 |
0 |
0.000 |
51 |
|
C |
3 |
1 |
5191 |
◊ |
B |
x-1/2,y-1/2,z |
3_445 |
5 |
1 |
5166 |
33.9 |
0.3 |
0.724 |
0 |
0 |
0 |
0.000 |
Average: |
34.2 |
0.3 |
0.725 |
0 |
0 |
0 |
0.000 |
28 |
52 |
|
E |
2 |
2 |
5317 |
◊ |
B |
-x,y,-z |
2_555 |
3 |
2 |
5166 |
25.5 |
-0.8 |
0.205 |
0 |
0 |
0 |
0.000 |
29 |
53 |
|
E |
3 |
1 |
5317 |
◊ |
A |
-x,y,-z |
2_555 |
1 |
1 |
5286 |
22.9 |
-0.7 |
0.152 |
0 |
0 |
0 |
0.000 |
54 |
|
D |
1 |
1 |
5242 |
◊ |
B |
-x,y,-z |
2_555 |
3 |
1 |
5166 |
20.8 |
-0.7 |
0.163 |
0 |
0 |
0 |
0.000 |
Average: |
21.8 |
-0.7 |
0.157 |
0 |
0 |
0 |
0.000 |
30 |
55 |
|
[MOO]B:1069 |
2 |
1 |
204 |
◊ |
C |
-x,y,-z |
2_555 |
5 |
3 |
5191 |
20.0 |
-0.8 |
0.431 |
0 |
0 |
0 |
0.023 |
31 |
56 |
|
[MOO]A:1069 |
2 |
1 |
205 |
◊ |
A |
-x,y,-z |
2_555 |
5 |
3 |
5286 |
19.7 |
-0.1 |
0.548 |
0 |
0 |
0 |
0.003 |
57 |
|
[MOO]D:1069 |
2 |
1 |
204 |
◊ |
D |
-x,y,-z+1 |
2_556 |
5 |
3 |
5242 |
17.7 |
-0.1 |
0.552 |
0 |
0 |
0 |
0.003 |
Average: |
18.7 |
-0.1 |
0.550 |
0 |
0 |
0 |
0.003 |
32 |
58 |
|
[MOO]C:1069 |
2 |
1 |
205 |
◊ |
B |
-x,y,-z |
2_555 |
5 |
3 |
5166 |
19.4 |
-0.1 |
0.552 |
0 |
0 |
0 |
0.003 |
33 |
59 |
|
[MOO]F:1069 |
2 |
1 |
204 |
◊ |
E |
-x,y,-z+1 |
2_556 |
5 |
2 |
5317 |
19.3 |
-0.1 |
0.542 |
0 |
0 |
0 |
0.004 |
34 |
60 |
|
C |
3 |
2 |
5191 |
◊ |
A |
-x-1/2,y-1/2,-z |
4_445 |
4 |
4 |
5286 |
18.9 |
0.8 |
0.846 |
0 |
0 |
0 |
0.000 |
61 |
|
D |
3 |
3 |
5242 |
◊ |
F |
-x+1/2,y-1/2,-z+1 |
4_546 |
3 |
3 |
5189 |
6.9 |
0.3 |
0.728 |
0 |
0 |
0 |
0.000 |
Average: |
12.9 |
0.6 |
0.787 |
0 |
0 |
0 |
0.000 |
35 |
62 |
|
[MOO]E:1069 |
2 |
1 |
206 |
◊ |
F |
-x,y,-z+1 |
2_556 |
4 |
2 |
5189 |
17.5 |
-0.7 |
0.534 |
0 |
0 |
0 |
0.020 |
36 |
63 |
|
[MOO]A:1069 |
4 |
1 |
205 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
5191 |
13.7 |
-0.4 |
0.522 |
0 |
0 |
0 |
0.013 |
64 |
|
[MOO]D:1069 |
4 |
1 |
204 |
◊ |
F |
x,y,z |
1_555 |
2 |
2 |
5189 |
11.1 |
-0.3 |
0.482 |
0 |
0 |
0 |
0.013 |
Average: |
12.4 |
-0.4 |
0.502 |
0 |
0 |
0 |
0.013 |
37 |
65 |
|
[MOO]B:1069 |
4 |
1 |
204 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
5286 |
13.5 |
-0.4 |
0.455 |
0 |
0 |
0 |
0.023 |
38 |
66 |
|
[MOO]E:1069 |
3 |
1 |
206 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
5242 |
13.1 |
-0.4 |
0.349 |
0 |
0 |
0 |
0.026 |
39 |
67 |
|
[MOO]F:1069 |
3 |
1 |
204 |
◊ |
E |
x,y,z |
1_555 |
2 |
2 |
5317 |
11.8 |
-0.3 |
0.503 |
0 |
0 |
0 |
0.009 |
40 |
68 |
|
[MOO]C:1069 |
3 |
1 |
205 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
5166 |
8.3 |
-0.2 |
0.443 |
0 |
0 |
0 |
0.008 |
41 |
69 |
|
E |
1 |
1 |
5317 |
◊ |
F |
x-1,y,z |
1_455 |
1 |
1 |
5189 |
3.2 |
0.2 |
0.761 |
0 |
0 |
0 |
0.000 |
42 |
70 |
|
F |
1 |
1 |
5189 |
◊ |
C |
-x,y,-z |
2_555 |
1 |
1 |
5191 |
2.2 |
0.2 |
0.793 |
0 |
0 |
0 |
0.000 |
|