## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
A |
47 |
13 |
7712 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
47 |
13 |
7712 |
439.6 |
-0.1 |
0.586 |
1 |
0 |
0 |
0.000 |
2 |
|
C |
43 |
5 |
1550 |
◊ |
A |
x,y,z |
1_555 |
49 |
14 |
7712 |
403.3 |
-2.9 |
0.583 |
5 |
0 |
0 |
0.018 |
3 |
|
A |
42 |
12 |
7712 |
x |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
37 |
12 |
7712 |
330.7 |
0.7 |
0.578 |
1 |
3 |
0 |
0.000 |
4 |
|
b |
29 |
2 |
697 |
◊ |
A |
x,y,z |
1_555 |
37 |
15 |
7712 |
260.7 |
-6.2 |
0.278 |
5 |
0 |
0 |
0.037 |
5 |
|
B |
21 |
3 |
1045 |
◊ |
A |
x,y,z |
1_555 |
32 |
12 |
7712 |
225.6 |
-5.3 |
0.316 |
3 |
0 |
0 |
0.034 |
6 |
|
B |
20 |
4 |
1045 |
◊ |
C |
x,y,z |
1_555 |
21 |
5 |
1550 |
182.3 |
-2.5 |
0.542 |
7 |
0 |
0 |
0.064 |
7 |
|
A |
17 |
4 |
7712 |
x |
A |
x-1/2,y+1/2,z |
3_455 |
18 |
5 |
7712 |
145.9 |
-0.8 |
0.465 |
1 |
2 |
0 |
0.000 |
8 |
|
b |
16 |
2 |
697 |
◊ |
C |
x,y,z |
1_555 |
17 |
3 |
1550 |
128.3 |
0.6 |
0.728 |
6 |
0 |
0 |
0.006 |
9 |
|
[EDO]A:209 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
13 |
7 |
7712 |
106.3 |
3.1 |
0.430 |
1 |
0 |
0 |
0.000 |
10 |
|
[EDO]A:210 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
20 |
5 |
7712 |
96.9 |
1.9 |
0.335 |
1 |
0 |
0 |
0.000 |
11 |
|
b |
12 |
1 |
697 |
◊ |
B |
-x+1/2,y-1/2,-z |
4_545 |
14 |
1 |
1045 |
96.6 |
2.5 |
0.843 |
0 |
0 |
0 |
0.000 |
12 |
|
C |
13 |
1 |
1550 |
x |
C |
-x+1/2,y-1/2,-z |
4_545 |
12 |
1 |
1550 |
93.7 |
1.8 |
0.734 |
0 |
0 |
0 |
0.000 |
13 |
|
[K]A:203 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
17 |
10 |
7712 |
89.4 |
-67.6 |
0.000 |
0 |
0 |
0 |
0.342 |
14 |
|
[IOD]A:205 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
17 |
6 |
7712 |
83.2 |
0.1 |
0.739 |
0 |
0 |
0 |
0.000 |
15 |
|
[K]A:204 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
7712 |
82.3 |
-51.4 |
0.000 |
0 |
0 |
0 |
0.260 |
16 |
|
[K]C:101 |
1 |
1 |
216 |
f |
C |
x,y,z |
1_555 |
7 |
4 |
1550 |
80.6 |
-49.5 |
0.000 |
0 |
0 |
0 |
0.884 |
17 |
|
b |
15 |
1 |
697 |
◊ |
B |
x,y,z |
1_555 |
12 |
1 |
1045 |
72.0 |
-0.3 |
0.672 |
1 |
0 |
0 |
0.003 |
18 |
|
[IOD]A:206 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
13 |
3 |
7712 |
70.2 |
-0.5 |
0.576 |
0 |
0 |
0 |
0.003 |
19 |
|
[IOD]A:207 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
7712 |
69.4 |
-0.5 |
0.501 |
0 |
0 |
0 |
0.003 |
20 |
|
[K]C:101 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
1045 |
61.8 |
-32.5 |
0.000 |
0 |
0 |
0 |
0.372 |
21 |
|
[EDO]A:210 |
4 |
1 |
184 |
f |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
9 |
3 |
7712 |
53.8 |
1.2 |
0.842 |
2 |
0 |
0 |
0.000 |
22 |
|
[K]A:203 |
1 |
1 |
216 |
◊ |
b |
x,y,z |
1_555 |
9 |
2 |
697 |
48.7 |
-26.0 |
0.000 |
0 |
0 |
0 |
0.115 |
23 |
|
C |
7 |
1 |
1550 |
◊ |
B |
-x+1/2,y-1/2,-z |
4_545 |
7 |
1 |
1045 |
46.8 |
0.7 |
0.651 |
0 |
0 |
0 |
0.000 |
24 |
|
[IOD]A:208 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
7712 |
46.0 |
-0.1 |
0.650 |
0 |
0 |
0 |
0.000 |
25 |
|
A |
6 |
2 |
7712 |
f |
[IOD]A:208 |
-x+1/2,y-1/2,-z+1 |
4_546 |
1 |
1 |
144 |
45.1 |
-0.3 |
0.577 |
0 |
0 |
0 |
0.002 |
26 |
|
[K]A:204 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
8 |
1 |
1045 |
43.3 |
-21.0 |
0.000 |
0 |
0 |
0 |
0.106 |
27 |
|
[K]A:204 |
1 |
1 |
216 |
◊ |
b |
x,y,z |
1_555 |
5 |
1 |
697 |
35.8 |
-18.1 |
0.000 |
0 |
0 |
0 |
0.080 |
28 |
|
A |
4 |
1 |
7712 |
◊ |
[K]C:101 |
-x+1/2,y-1/2,-z |
4_545 |
1 |
1 |
216 |
33.3 |
-15.0 |
0.000 |
0 |
0 |
0 |
0.064 |
29 |
|
[EDO]A:209 |
2 |
1 |
184 |
f |
A |
-x+1,y,-z+1 |
2_656 |
3 |
1 |
7712 |
32.9 |
0.9 |
0.897 |
1 |
0 |
0 |
0.000 |
30 |
|
[IOD]A:207 |
1 |
1 |
144 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
5 |
2 |
7712 |
31.7 |
-0.3 |
0.593 |
0 |
0 |
0 |
0.000 |
31 |
|
A |
4 |
2 |
7712 |
◊ |
B |
-x+1/2,y-1/2,-z |
4_545 |
2 |
1 |
1045 |
27.8 |
-0.8 |
0.398 |
0 |
0 |
0 |
0.003 |
32 |
|
[MG]A:201 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
7712 |
27.4 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.018 |
33 |
|
[MG]A:202 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
7712 |
25.7 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.023 |
34 |
|
[MG]A:201 |
1 |
1 |
98 |
◊ |
b |
x,y,z |
1_555 |
5 |
2 |
697 |
21.3 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.014 |
35 |
|
[MG]A:202 |
1 |
1 |
98 |
◊ |
b |
x,y,z |
1_555 |
4 |
1 |
697 |
18.5 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.012 |
36 |
|
b |
4 |
1 |
697 |
◊ |
C |
-x+1/2,y-1/2,-z |
4_545 |
3 |
1 |
1550 |
17.1 |
-1.0 |
0.426 |
0 |
0 |
0 |
0.018 |
37 |
|
[K]A:203 |
1 |
1 |
216 |
f |
[MG]A:201 |
x,y,z |
1_555 |
1 |
1 |
98 |
17.1 |
-10.6 |
0.000 |
0 |
0 |
0 |
0.054 |
38 |
|
[MG]A:202 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
1045 |
16.4 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.005 |
39 |
|
[K]A:204 |
1 |
1 |
216 |
f |
[K]A:203 |
x,y,z |
1_555 |
1 |
1 |
216 |
14.4 |
-14.4 |
0.000 |
0 |
0 |
0 |
0.073 |
40 |
|
[K]A:204 |
1 |
1 |
216 |
f |
[MG]A:201 |
x,y,z |
1_555 |
1 |
1 |
98 |
13.0 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.041 |
41 |
|
[K]A:204 |
1 |
1 |
216 |
f |
[MG]A:202 |
x,y,z |
1_555 |
1 |
1 |
98 |
10.9 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.033 |
42 |
|
b |
4 |
1 |
697 |
◊ |
[K]C:101 |
-x+1/2,y-1/2,-z |
4_545 |
1 |
1 |
216 |
9.6 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.098 |
43 |
|
C |
2 |
1 |
1550 |
◊ |
A |
-x+1/2,y-1/2,-z |
4_545 |
2 |
2 |
7712 |
7.8 |
0.1 |
0.496 |
0 |
0 |
0 |
0.000 |
44 |
|
[MG]A:202 |
1 |
1 |
98 |
f |
[MG]A:201 |
x,y,z |
1_555 |
1 |
1 |
98 |
7.6 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.008 |
45 |
|
[IOD]A:205 |
1 |
1 |
144 |
f |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
2 |
2 |
7712 |
2.4 |
-0.0 |
0.746 |
0 |
0 |
0 |
0.000 |
|