## |
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 |
|
B |
174 |
46 |
14677 |
◊ |
B |
-x,y,-z |
2_555 |
174 |
47 |
14677 |
1612.7 |
-11.6 |
0.219 |
20 |
8 |
0 |
0.079 |
2 |
|
B |
150 |
41 |
14677 |
◊ |
A |
x,y,z |
1_555 |
133 |
40 |
11157 |
1387.6 |
-10.9 |
0.207 |
24 |
2 |
0 |
0.126 |
3 |
|
B |
57 |
14 |
14677 |
◊ |
B |
-x,y,-z+1 |
2_556 |
56 |
14 |
14677 |
515.9 |
-0.2 |
0.670 |
16 |
4 |
0 |
0.029 |
4 |
|
B |
37 |
13 |
14677 |
◊ |
A |
-x-1/2,y-1/2,-z |
4_445 |
35 |
10 |
11157 |
341.3 |
-1.2 |
0.515 |
5 |
0 |
0 |
0.000 |
5 |
|
[F9F]A:301 |
22 |
1 |
501 |
f |
A |
x,y,z |
1_555 |
51 |
23 |
11157 |
338.2 |
-2.4 |
0.419 |
8 |
0 |
0 |
0.035 |
6 |
|
A |
27 |
8 |
11157 |
x |
A |
-x-1/2,y-1/2,-z+1 |
4_446 |
27 |
7 |
11157 |
260.2 |
-1.6 |
0.491 |
3 |
4 |
0 |
0.000 |
7 |
|
[DMS]A:302 |
4 |
1 |
205 |
f |
A |
x,y,z |
1_555 |
24 |
11 |
11157 |
133.4 |
3.4 |
0.628 |
0 |
0 |
0 |
0.000 |
8 |
|
[DMS]A:304 |
4 |
1 |
204 |
f |
A |
x,y,z |
1_555 |
24 |
12 |
11157 |
131.1 |
4.1 |
0.674 |
1 |
0 |
0 |
0.000 |
9 |
|
[DMS]A:303 |
4 |
1 |
204 |
f |
A |
x,y,z |
1_555 |
18 |
10 |
11157 |
120.7 |
3.1 |
0.529 |
1 |
0 |
0 |
0.000 |
10 |
|
[CS]B:403 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
13 |
10 |
14677 |
115.7 |
-43.2 |
0.000 |
0 |
0 |
0 |
0.321 |
11 |
|
[CS]B:401 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
19 |
9 |
14677 |
112.1 |
-31.0 |
0.000 |
0 |
0 |
0 |
0.230 |
12 |
|
[DMS]A:305 |
4 |
1 |
205 |
◊ |
A |
x,y,z |
1_555 |
17 |
6 |
11157 |
109.1 |
2.9 |
0.510 |
1 |
0 |
0 |
0.000 |
13 |
|
[DMS]B:404 |
4 |
1 |
204 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
14677 |
108.2 |
1.5 |
0.418 |
0 |
0 |
0 |
0.000 |
14 |
|
[DMS]A:306 |
4 |
1 |
205 |
◊ |
A |
x,y,z |
1_555 |
13 |
5 |
11157 |
100.7 |
1.8 |
0.504 |
2 |
0 |
0 |
0.000 |
15 |
|
[DMS]B:405 |
4 |
1 |
205 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
14677 |
90.3 |
2.1 |
0.465 |
1 |
0 |
0 |
0.000 |
16 |
|
[CL]B:414 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
15 |
8 |
14677 |
78.3 |
-10.4 |
0.000 |
0 |
0 |
0 |
0.077 |
17 |
|
[DMS]B:406 |
4 |
1 |
205 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
14677 |
76.9 |
1.3 |
0.337 |
0 |
0 |
0 |
0.000 |
18 |
|
[DMS]B:407 |
4 |
1 |
207 |
◊ |
B |
-x,y,-z |
2_555 |
12 |
5 |
14677 |
74.2 |
-0.1 |
0.323 |
0 |
0 |
0 |
0.000 |
19 |
|
[DMS]B:407 |
3 |
1 |
207 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
14677 |
73.8 |
2.3 |
0.410 |
0 |
0 |
0 |
0.000 |
20 |
|
[EDO]B:402 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
10 |
3 |
14677 |
72.1 |
2.5 |
0.299 |
1 |
0 |
0 |
0.000 |
21 |
|
[CL]A:308 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
11157 |
71.7 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.053 |
22 |
|
B |
5 |
2 |
14677 |
◊ |
A |
x,y-1,z |
1_545 |
6 |
3 |
11157 |
69.7 |
-0.0 |
0.320 |
1 |
0 |
0 |
0.000 |
23 |
|
[CL]A:307 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
11157 |
68.5 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.055 |
24 |
|
[CL]B:418 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
13 |
4 |
14677 |
66.5 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.070 |
25 |
|
[CL]B:417 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
14677 |
65.4 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.067 |
26 |
|
B |
13 |
3 |
14677 |
f |
[DMS]A:305 |
-x-1/2,y-1/2,-z |
4_445 |
3 |
1 |
205 |
63.3 |
1.2 |
0.342 |
0 |
0 |
0 |
0.000 |
27 |
|
[CL]B:411 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
14677 |
61.0 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.061 |
28 |
|
[CL]B:413 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
14677 |
57.0 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.050 |
29 |
|
[CL]A:309 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
11157 |
54.8 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.040 |
30 |
|
[CL]B:409 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
14677 |
53.4 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.051 |
31 |
|
[CL]B:415 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
14677 |
48.7 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.046 |
32 |
|
B |
4 |
2 |
14677 |
◊ |
[CL]A:309 |
-x-1/2,y-1/2,-z |
4_445 |
1 |
1 |
125 |
39.8 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.000 |
33 |
|
[CL]B:410 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
14677 |
39.3 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.037 |
34 |
|
A |
5 |
3 |
11157 |
x |
A |
-x-1/2,y-1/2,-z |
4_445 |
4 |
2 |
11157 |
35.6 |
0.2 |
0.637 |
0 |
0 |
0 |
0.000 |
35 |
|
[EDO]B:402 |
4 |
1 |
183 |
f |
[DMS]B:406 |
x,y,z |
1_555 |
2 |
1 |
205 |
32.6 |
1.4 |
0.866 |
0 |
0 |
0 |
0.000 |
36 |
|
[CL]B:416 |
1 |
1 |
125 |
f |
B |
-x,y,-z+1 |
2_556 |
7 |
2 |
14677 |
31.9 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.027 |
37 |
|
[CL]B:416 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
14677 |
30.9 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.023 |
38 |
|
[F9F]A:301 |
1 |
1 |
501 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
14677 |
28.3 |
0.3 |
0.525 |
0 |
0 |
0 |
0.000 |
39 |
|
[DMS]B:407 |
1 |
1 |
207 |
◊ |
[DMS]B:407 |
-x,y,-z |
2_555 |
1 |
1 |
207 |
26.9 |
1.8 |
0.500 |
0 |
0 |
0 |
0.000 |
40 |
|
[CL]B:418 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
11157 |
23.1 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.014 |
41 |
|
A |
5 |
2 |
11157 |
x |
A |
x,y-1,z |
1_545 |
1 |
1 |
11157 |
21.2 |
-0.2 |
0.253 |
0 |
0 |
0 |
0.000 |
42 |
|
[EDO]B:402 |
1 |
1 |
183 |
f |
[DMS]B:404 |
x,y,z |
1_555 |
2 |
1 |
204 |
13.9 |
0.9 |
0.468 |
0 |
0 |
0 |
0.000 |
43 |
|
[CL]B:413 |
1 |
1 |
125 |
◊ |
B |
-x,y,-z+1 |
2_556 |
1 |
1 |
14677 |
2.1 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.001 |
44 |
|
A |
2 |
1 |
11157 |
f |
[DMS]A:306 |
-x-1/2,y-1/2,-z+1 |
4_446 |
2 |
1 |
205 |
1.6 |
0.1 |
0.545 |
0 |
0 |
0 |
0.000 |
45 |
|
[CL]B:411 |
1 |
1 |
125 |
f |
[DMS]B:407 |
x,y,z |
1_555 |
1 |
1 |
207 |
1.5 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
46 |
|
A |
1 |
1 |
11157 |
◊ |
[CS]B:401 |
x-1/2,y+1/2,z |
3_455 |
1 |
1 |
216 |
1.2 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.000 |
|