## |
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 |
|
D |
103 |
18 |
4243 |
◊ |
C |
x,y,z |
1_555 |
96 |
17 |
4010 |
892.0 |
-1.5 |
0.972 |
38 |
0 |
0 |
0.682 |
2 |
|
P |
43 |
8 |
2025 |
◊ |
B |
x,y,z |
1_555 |
47 |
9 |
2894 |
388.7 |
2.2 |
0.963 |
16 |
0 |
0 |
0.015 |
3 |
|
C |
26 |
5 |
4010 |
◊ |
B |
x,y,z |
1_555 |
24 |
4 |
2894 |
206.7 |
-0.2 |
0.853 |
2 |
0 |
0 |
0.000 |
4 |
|
P |
23 |
2 |
2025 |
◊ |
C |
x,y,z |
1_555 |
21 |
4 |
4010 |
169.1 |
-0.5 |
0.834 |
4 |
0 |
0 |
0.000 |
5 |
|
D |
21 |
3 |
4243 |
◊ |
B |
x,y,z |
1_555 |
18 |
5 |
2894 |
168.9 |
0.4 |
0.851 |
2 |
0 |
0 |
0.000 |
6 |
|
P |
19 |
2 |
2025 |
◊ |
D |
x,y,z |
1_555 |
20 |
3 |
4243 |
166.0 |
0.5 |
0.873 |
2 |
0 |
0 |
0.000 |
7 |
|
B |
16 |
5 |
2894 |
◊ |
A |
x,y,z |
1_555 |
17 |
4 |
1013 |
164.1 |
-2.6 |
0.701 |
10 |
0 |
0 |
0.273 |
8 |
|
[AVC]A:5 |
16 |
1 |
514 |
◊ |
B |
x,y,z |
1_555 |
23 |
5 |
2894 |
149.8 |
2.3 |
0.798 |
4 |
0 |
0 |
0.000 |
9 |
|
C |
16 |
3 |
4010 |
◊ |
D |
x-y,x,z+1/6 |
6_555 |
21 |
4 |
4243 |
142.0 |
-0.9 |
0.800 |
2 |
0 |
0 |
0.000 |
10 |
|
D |
18 |
3 |
4243 |
◊ |
A |
x,y,z |
1_555 |
11 |
2 |
1013 |
124.6 |
-3.5 |
0.499 |
0 |
0 |
0 |
0.000 |
11 |
|
[AVC]A:5 |
16 |
1 |
514 |
cf |
A |
x,y,z |
1_555 |
17 |
2 |
1013 |
119.1 |
2.0 |
0.768 |
0 |
0 |
0 |
0.000 |
12 |
|
[NCO]B:102 |
6 |
1 |
270 |
◊ |
B |
x,y,z |
1_555 |
15 |
5 |
2894 |
116.4 |
-2.3 |
0.272 |
5 |
0 |
0 |
0.175 |
13 |
|
D |
13 |
3 |
4243 |
◊ |
D |
-x+y+1,y,-z+1/2 |
11_655 |
13 |
3 |
4243 |
111.0 |
-3.1 |
0.598 |
0 |
0 |
0 |
0.000 |
14 |
|
[NCO]C:101 |
5 |
1 |
267 |
f |
C |
x,y,z |
1_555 |
15 |
3 |
4010 |
109.3 |
-2.8 |
0.213 |
4 |
0 |
0 |
0.170 |
15 |
|
P |
17 |
1 |
2025 |
◊ |
B |
x-y,-y,-z+1 |
8_556 |
14 |
1 |
2894 |
109.0 |
2.0 |
0.896 |
0 |
0 |
0 |
0.000 |
16 |
|
C |
15 |
3 |
4010 |
x |
C |
x-y,x,z+1/6 |
6_555 |
12 |
2 |
4010 |
106.3 |
-2.0 |
0.638 |
1 |
0 |
0 |
0.000 |
17 |
|
[AVC]A:5 |
9 |
1 |
514 |
◊ |
D |
x,y,z |
1_555 |
11 |
3 |
4243 |
98.8 |
-0.1 |
0.605 |
1 |
0 |
0 |
0.000 |
18 |
|
C |
13 |
1 |
4010 |
x |
C |
-x+1,-x+y,-z+2/3 |
9_655 |
15 |
1 |
4010 |
93.5 |
3.6 |
0.933 |
0 |
0 |
0 |
0.000 |
19 |
|
A |
9 |
2 |
1013 |
◊ |
A |
-y+1,-x+1,-z+5/6 |
10_665 |
9 |
2 |
1013 |
89.0 |
-1.9 |
0.632 |
0 |
0 |
0 |
0.000 |
20 |
|
B |
13 |
1 |
2894 |
◊ |
A |
-y+1,-x+1,-z+5/6 |
10_665 |
12 |
1 |
1013 |
81.9 |
1.2 |
0.851 |
0 |
0 |
0 |
0.000 |
21 |
|
[NCO]C:101 |
4 |
1 |
267 |
◊ |
D |
x,y,z |
1_555 |
10 |
2 |
4243 |
79.6 |
-1.8 |
0.301 |
5 |
0 |
0 |
0.148 |
22 |
|
D |
10 |
1 |
4243 |
x |
D |
-x+1,-x+y,-z+2/3 |
9_655 |
12 |
1 |
4243 |
79.1 |
3.0 |
0.928 |
0 |
0 |
0 |
0.000 |
23 |
|
D |
8 |
2 |
4243 |
x |
D |
x-y,x,z+1/6 |
6_555 |
9 |
3 |
4243 |
72.8 |
-3.9 |
0.371 |
0 |
0 |
0 |
0.000 |
24 |
|
[AVC]A:5 |
4 |
1 |
514 |
◊ |
P |
x,y,z |
1_555 |
10 |
3 |
2025 |
70.7 |
-2.1 |
0.374 |
0 |
0 |
0 |
0.006 |
25 |
|
D |
11 |
1 |
4243 |
◊ |
C |
-x+1,-x+y,-z+2/3 |
9_655 |
12 |
1 |
4010 |
68.8 |
0.4 |
0.794 |
0 |
0 |
0 |
0.000 |
26 |
|
[S9L]B:14 |
6 |
1 |
378 |
cf |
B |
x,y,z |
1_555 |
9 |
1 |
2894 |
65.9 |
-1.2 |
0.664 |
0 |
0 |
0 |
0.100 |
27 |
|
[SO4]A:103 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
1013 |
62.7 |
-7.9 |
0.901 |
1 |
0 |
0 |
0.324 |
28 |
|
[S9L]B:14 |
5 |
1 |
378 |
c |
C |
x,y,z |
1_555 |
4 |
1 |
4010 |
59.9 |
-1.0 |
0.622 |
0 |
0 |
0 |
0.000 |
29 |
|
C |
9 |
1 |
4010 |
◊ |
[S9L]B:14 |
-x+1,-x+y,-z+2/3 |
9_655 |
4 |
1 |
378 |
52.1 |
-0.7 |
0.672 |
0 |
0 |
0 |
0.000 |
30 |
|
[S9L]B:14 |
6 |
1 |
378 |
◊ |
D |
x,y,z |
1_555 |
8 |
2 |
4243 |
49.4 |
-0.5 |
0.734 |
0 |
0 |
0 |
0.000 |
31 |
|
[NCO]B:102 |
4 |
1 |
270 |
f |
A |
x,y,z |
1_555 |
4 |
3 |
1013 |
47.1 |
1.6 |
0.433 |
0 |
0 |
0 |
0.000 |
32 |
|
B |
6 |
1 |
2894 |
◊ |
B |
x-y,-y,-z+1 |
8_556 |
6 |
1 |
2894 |
46.7 |
0.8 |
0.746 |
0 |
0 |
0 |
0.000 |
33 |
|
C |
4 |
1 |
4010 |
◊ |
C |
-x+y+1,y,-z+1/2 |
11_655 |
4 |
1 |
4010 |
45.9 |
-2.5 |
0.320 |
0 |
0 |
0 |
0.000 |
34 |
|
[NCO]B:102 |
3 |
1 |
270 |
f |
[SO4]A:103 |
x,y,z |
1_555 |
4 |
1 |
185 |
41.2 |
-4.5 |
0.353 |
3 |
0 |
0 |
0.226 |
35 |
|
[S9L]B:14 |
5 |
1 |
378 |
◊ |
A |
-y+1,-x+1,-z+5/6 |
10_665 |
4 |
1 |
1013 |
38.7 |
-3.2 |
0.368 |
0 |
0 |
0 |
0.000 |
36 |
|
P |
3 |
1 |
2025 |
◊ |
P |
x-y,-y,-z+1 |
8_556 |
3 |
1 |
2025 |
21.1 |
0.6 |
0.673 |
0 |
0 |
0 |
0.000 |
37 |
|
[NCO]B:102 |
1 |
1 |
270 |
◊ |
A |
-y+1,-x+1,-z+5/6 |
10_665 |
3 |
1 |
1013 |
17.4 |
0.4 |
0.834 |
0 |
0 |
0 |
0.000 |
38 |
|
[SO4]A:103 |
2 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
3 |
3 |
2894 |
17.0 |
-3.0 |
0.588 |
0 |
0 |
0 |
0.115 |
39 |
|
A |
2 |
2 |
1013 |
◊ |
C |
x-y,x,z+1/6 |
6_555 |
1 |
1 |
4010 |
14.4 |
-1.4 |
0.295 |
0 |
0 |
0 |
0.000 |
40 |
|
[NCO]B:102 |
1 |
1 |
270 |
◊ |
[SO4]A:103 |
-y+1,-x+1,-z+5/6 |
10_665 |
1 |
1 |
185 |
1.8 |
-0.2 |
1.000 |
0 |
0 |
0 |
0.000 |
|