| ## |
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 |
188 |
47 |
10598 |
◊ |
A |
x,y,z |
1_555 |
176 |
48 |
9810 |
1755.4 |
-7.4 |
0.233 |
26 |
15 |
0 |
1.000 |
2 |
|
D |
172 |
47 |
9909 |
◊ |
C |
x,y,z |
1_555 |
172 |
47 |
9784 |
1679.2 |
-7.4 |
0.258 |
25 |
15 |
0 |
1.000 |
3 |
|
F |
179 |
46 |
9911 |
◊ |
E |
x,y,z |
1_555 |
172 |
48 |
9927 |
1677.4 |
-6.9 |
0.240 |
28 |
14 |
0 |
1.000 |
4 |
|
H |
176 |
46 |
10042 |
◊ |
G |
x,y,z |
1_555 |
176 |
50 |
9760 |
1663.0 |
-6.9 |
0.239 |
29 |
13 |
0 |
1.000 |
| Average: |
1693.7 |
-7.2 |
0.242 |
27 |
14 |
0 |
1.000 |
| 2 |
5 |
|
G |
62 |
12 |
9760 |
◊ |
D |
x-1/2,-y-1/2,-z |
4_445 |
67 |
21 |
9909 |
669.5 |
1.2 |
0.555 |
10 |
9 |
0 |
0.000 |
6 |
|
C |
61 |
12 |
9784 |
◊ |
H |
x-1/2,-y-1/2,-z |
4_445 |
66 |
21 |
10042 |
622.8 |
-0.6 |
0.379 |
10 |
10 |
0 |
0.000 |
7 |
|
G |
72 |
21 |
9760 |
◊ |
F |
-x-1/2,-y,z-1/2 |
2_454 |
60 |
12 |
9911 |
617.6 |
-0.5 |
0.379 |
10 |
11 |
0 |
0.000 |
8 |
|
B |
62 |
13 |
10598 |
◊ |
A |
x-1/2,-y-1/2,-z+1 |
4_446 |
64 |
21 |
9810 |
616.4 |
-2.3 |
0.363 |
9 |
8 |
0 |
0.000 |
9 |
|
H |
60 |
12 |
10042 |
◊ |
E |
-x+1/2,-y,z-1/2 |
2_554 |
65 |
21 |
9927 |
579.2 |
-0.2 |
0.512 |
12 |
9 |
0 |
0.000 |
10 |
|
C |
66 |
21 |
9784 |
◊ |
D |
x-1/2,-y-1/2,-z |
4_445 |
59 |
12 |
9909 |
557.3 |
-1.6 |
0.435 |
11 |
13 |
0 |
0.000 |
| Average: |
610.5 |
-0.7 |
0.437 |
10 |
10 |
0 |
0.000 |
| 3 |
11 |
|
K |
47 |
8 |
1355 |
◊ |
F |
x,y,z |
1_555 |
80 |
22 |
9911 |
596.6 |
-10.3 |
0.249 |
3 |
0 |
0 |
1.000 |
| 4 |
12 |
|
Z |
53 |
12 |
2809 |
◊ |
W |
x,y,z |
1_555 |
52 |
12 |
2815 |
523.8 |
-8.0 |
0.610 |
28 |
0 |
0 |
1.000 |
13 |
|
T |
53 |
12 |
2807 |
◊ |
R |
x,y,z |
1_555 |
55 |
12 |
2821 |
523.0 |
-8.8 |
0.574 |
30 |
0 |
0 |
1.000 |
| Average: |
523.4 |
-8.4 |
0.592 |
29 |
0 |
0 |
1.000 |
| 5 |
14 |
|
E |
54 |
15 |
9927 |
◊ |
A |
x,y,z |
1_555 |
49 |
18 |
9810 |
516.1 |
3.3 |
0.736 |
10 |
3 |
0 |
0.000 |
| 6 |
15 |
|
A |
50 |
13 |
9810 |
◊ |
G |
-x,y-1/2,-z+1/2 |
3_545 |
56 |
17 |
9760 |
448.8 |
0.3 |
0.543 |
9 |
8 |
0 |
0.000 |
| 7 |
16 |
|
T |
35 |
7 |
2807 |
◊ |
G |
x,y,z |
1_555 |
42 |
15 |
9760 |
366.0 |
-6.6 |
0.327 |
9 |
0 |
0 |
1.000 |
17 |
|
R |
37 |
8 |
2821 |
◊ |
E |
x,y,z |
1_555 |
43 |
13 |
9927 |
357.7 |
-6.5 |
0.338 |
8 |
0 |
0 |
1.000 |
18 |
|
Z |
34 |
8 |
2809 |
◊ |
A |
x,y,z |
1_555 |
41 |
13 |
9810 |
350.6 |
-6.4 |
0.356 |
7 |
0 |
0 |
1.000 |
19 |
|
W |
36 |
8 |
2815 |
◊ |
C |
x,y,z |
1_555 |
40 |
13 |
9784 |
350.4 |
-5.6 |
0.369 |
8 |
0 |
0 |
1.000 |
| Average: |
356.2 |
-6.3 |
0.348 |
8 |
0 |
0 |
1.000 |
| 8 |
20 |
|
R |
30 |
3 |
2821 |
◊ |
H |
x,y,z |
1_555 |
38 |
12 |
10042 |
288.3 |
-3.6 |
0.457 |
8 |
0 |
0 |
0.210 |
21 |
|
T |
30 |
3 |
2807 |
◊ |
F |
x,y,z |
1_555 |
37 |
13 |
9911 |
287.6 |
-4.3 |
0.368 |
8 |
0 |
0 |
0.210 |
22 |
|
Z |
28 |
3 |
2809 |
◊ |
D |
x,y,z |
1_555 |
35 |
11 |
9909 |
285.8 |
-4.1 |
0.384 |
6 |
0 |
0 |
0.210 |
23 |
|
W |
29 |
3 |
2815 |
◊ |
B |
x,y,z |
1_555 |
37 |
12 |
10598 |
279.4 |
-3.8 |
0.417 |
7 |
0 |
0 |
0.210 |
| Average: |
285.3 |
-4.0 |
0.407 |
7 |
0 |
0 |
0.210 |
| 9 |
24 |
|
T |
22 |
5 |
2807 |
◊ |
E |
x,y,z |
1_555 |
26 |
8 |
9927 |
225.6 |
-6.4 |
0.223 |
4 |
0 |
0 |
0.260 |
25 |
|
W |
24 |
5 |
2815 |
◊ |
A |
x,y,z |
1_555 |
27 |
9 |
9810 |
223.0 |
-5.4 |
0.247 |
3 |
0 |
0 |
0.260 |
26 |
|
Z |
25 |
5 |
2809 |
◊ |
C |
x,y,z |
1_555 |
29 |
9 |
9784 |
222.7 |
-5.2 |
0.283 |
3 |
0 |
0 |
0.260 |
27 |
|
R |
24 |
5 |
2821 |
◊ |
G |
x,y,z |
1_555 |
27 |
9 |
9760 |
222.1 |
-5.5 |
0.249 |
3 |
0 |
0 |
0.260 |
| Average: |
223.4 |
-5.6 |
0.251 |
3 |
0 |
0 |
0.260 |
| 10 |
28 |
|
B |
8 |
3 |
10598 |
◊ |
A |
x-1,y,z |
1_455 |
13 |
4 |
9810 |
105.9 |
-1.4 |
0.270 |
0 |
0 |
0 |
0.000 |
| 11 |
29 |
|
Z |
8 |
2 |
2809 |
◊ |
F |
x,y,z |
1_555 |
7 |
3 |
9911 |
64.1 |
0.3 |
0.654 |
2 |
0 |
0 |
0.000 |
30 |
|
B |
9 |
3 |
10598 |
◊ |
T |
-x,y-1/2,-z+1/2 |
3_545 |
6 |
2 |
2807 |
62.9 |
-2.9 |
0.215 |
0 |
0 |
0 |
0.000 |
| Average: |
63.5 |
-1.3 |
0.434 |
1 |
0 |
0 |
0.000 |
| 12 |
31 |
|
B |
5 |
3 |
10598 |
◊ |
H |
-x,y-1/2,-z+1/2 |
3_545 |
5 |
2 |
10042 |
48.9 |
0.3 |
0.658 |
1 |
0 |
0 |
0.000 |
| 13 |
32 |
|
G |
2 |
1 |
9760 |
◊ |
F |
x,y,z |
1_555 |
6 |
2 |
9911 |
31.3 |
0.8 |
0.764 |
2 |
2 |
0 |
0.000 |
33 |
|
D |
5 |
1 |
9909 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
9810 |
28.9 |
0.8 |
0.781 |
1 |
1 |
0 |
0.000 |
34 |
|
C |
2 |
1 |
9784 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
10598 |
23.8 |
0.5 |
0.697 |
0 |
0 |
0 |
0.000 |
35 |
|
H |
3 |
1 |
10042 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
9927 |
16.1 |
0.4 |
0.738 |
0 |
0 |
0 |
0.000 |
| Average: |
25.0 |
0.6 |
0.745 |
1 |
1 |
0 |
0.000 |
| 14 |
36 |
|
Z |
2 |
2 |
2809 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
10598 |
26.5 |
-1.3 |
0.330 |
0 |
0 |
0 |
0.040 |
37 |
|
T |
1 |
1 |
2807 |
◊ |
H |
x,y,z |
1_555 |
4 |
1 |
10042 |
15.5 |
-1.0 |
0.291 |
0 |
0 |
0 |
0.040 |
38 |
|
R |
1 |
1 |
2821 |
◊ |
F |
x,y,z |
1_555 |
4 |
1 |
9911 |
15.1 |
-1.0 |
0.281 |
0 |
0 |
0 |
0.040 |
39 |
|
W |
1 |
1 |
2815 |
◊ |
D |
x,y,z |
1_555 |
4 |
1 |
9909 |
13.0 |
-0.8 |
0.302 |
0 |
0 |
0 |
0.040 |
| Average: |
17.5 |
-1.0 |
0.301 |
0 |
0 |
0 |
0.040 |
| 15 |
40 |
|
A |
3 |
1 |
9810 |
◊ |
H |
-x,y-1/2,-z+1/2 |
3_545 |
2 |
1 |
10042 |
21.6 |
0.5 |
0.799 |
0 |
0 |
0 |
0.000 |
41 |
|
E |
2 |
1 |
9927 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
10598 |
12.5 |
0.3 |
0.818 |
0 |
0 |
0 |
0.000 |
| Average: |
17.0 |
0.4 |
0.808 |
0 |
0 |
0 |
0.000 |
| 16 |
42 |
|
D |
2 |
1 |
9909 |
◊ |
E |
-x,y-1/2,-z+1/2 |
3_545 |
2 |
1 |
9927 |
13.5 |
0.7 |
0.866 |
0 |
0 |
0 |
0.000 |
| 17 |
43 |
|
F |
1 |
1 |
9911 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
10598 |
2.9 |
0.1 |
0.747 |
0 |
0 |
0 |
0.000 |
|