## |
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 |
79 |
25 |
12920 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
78 |
25 |
12920 |
714.6 |
-1.7 |
0.606 |
12 |
8 |
0 |
0.000 |
2 |
|
A |
44 |
13 |
12920 |
◊ |
A |
-x+1,y,-z |
2_655 |
44 |
13 |
12920 |
429.1 |
-7.2 |
0.100 |
4 |
0 |
0 |
0.045 |
3 |
|
A |
36 |
8 |
12920 |
x |
A |
x-1/2,y-1/2,z |
3_445 |
52 |
15 |
12920 |
397.7 |
-1.9 |
0.510 |
5 |
4 |
0 |
0.000 |
4 |
|
A |
43 |
13 |
12920 |
x |
A |
x-1/2,y+1/2,z |
3_455 |
43 |
13 |
12920 |
385.5 |
-2.3 |
0.378 |
5 |
3 |
0 |
0.000 |
5 |
|
[CXS]A:300 |
13 |
1 |
401 |
f |
A |
x,y,z |
1_555 |
29 |
10 |
12920 |
216.7 |
6.0 |
0.200 |
2 |
0 |
0 |
0.000 |
6 |
|
[CXS]A:301 |
14 |
1 |
402 |
◊ |
A |
x,y,z |
1_555 |
26 |
6 |
12920 |
167.3 |
3.7 |
0.015 |
3 |
0 |
0 |
0.000 |
7 |
|
[CXS]A:301 |
10 |
1 |
402 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
17 |
7 |
12920 |
118.1 |
3.6 |
0.084 |
1 |
0 |
0 |
0.000 |
8 |
|
[EDO]A:306 |
4 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
20 |
10 |
12920 |
113.9 |
4.1 |
0.663 |
3 |
0 |
0 |
0.000 |
9 |
|
[EDO]A:307 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
12920 |
103.6 |
2.0 |
0.296 |
0 |
0 |
0 |
0.000 |
10 |
|
[SO4]A:304 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
12920 |
100.4 |
-15.2 |
0.744 |
2 |
0 |
0 |
0.161 |
11 |
|
[SO4]A:303 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
16 |
5 |
12920 |
97.6 |
-12.7 |
0.926 |
4 |
0 |
0 |
0.144 |
12 |
|
[SO4]A:302 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
12920 |
92.9 |
-12.5 |
0.846 |
3 |
0 |
0 |
0.138 |
13 |
|
[SO4]A:305 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
12920 |
89.4 |
-13.1 |
0.775 |
5 |
0 |
0 |
0.153 |
14 |
|
[EDO]A:309 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
14 |
6 |
12920 |
89.2 |
2.7 |
0.284 |
1 |
0 |
0 |
0.000 |
15 |
|
[CL]A:311 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
12920 |
81.1 |
-11.0 |
0.000 |
0 |
0 |
0 |
0.110 |
16 |
|
[CL]A:314 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
12920 |
78.3 |
-11.7 |
0.000 |
0 |
0 |
0 |
0.117 |
17 |
|
[EDO]A:308 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
12920 |
77.6 |
2.7 |
0.915 |
2 |
0 |
0 |
0.000 |
18 |
|
[EDO]A:310 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
3 |
12920 |
75.5 |
2.0 |
0.249 |
1 |
0 |
0 |
0.000 |
19 |
|
[CL]A:313 |
1 |
1 |
125 |
f |
[CL]A:313 |
-x+1,y,-z |
2_655 |
1 |
1 |
125 |
59.7 |
-11.9 |
0.000 |
0 |
0 |
0 |
0.100 |
20 |
|
[CL]A:312 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
3 |
12920 |
51.7 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.067 |
21 |
|
A |
6 |
2 |
12920 |
◊ |
[SO4]A:304 |
x-1/2,y+1/2,z |
3_455 |
4 |
1 |
185 |
49.1 |
-5.5 |
0.808 |
1 |
0 |
0 |
0.000 |
22 |
|
[CL]A:313 |
1 |
1 |
125 |
x |
A |
x,y,z |
1_555 |
7 |
3 |
12920 |
45.9 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.123 |
23 |
|
A |
5 |
2 |
12920 |
◊ |
[SO4]A:302 |
x-1/2,y+1/2,z |
3_455 |
4 |
1 |
185 |
41.8 |
-4.8 |
0.765 |
0 |
0 |
0 |
0.000 |
24 |
|
A |
5 |
3 |
12920 |
◊ |
[SO4]A:303 |
x-1/2,y+1/2,z |
3_455 |
4 |
1 |
185 |
37.6 |
-4.8 |
0.650 |
0 |
0 |
0 |
0.000 |
25 |
|
[EDO]A:307 |
2 |
1 |
186 |
f |
[CXS]A:300 |
x,y,z |
1_555 |
6 |
1 |
401 |
34.6 |
1.8 |
0.036 |
0 |
0 |
0 |
0.000 |
26 |
|
[EDO]A:310 |
3 |
1 |
185 |
f |
[CXS]A:300 |
x,y,z |
1_555 |
6 |
1 |
401 |
34.1 |
1.3 |
0.020 |
1 |
0 |
0 |
0.000 |
27 |
|
A |
7 |
3 |
12920 |
◊ |
[CL]A:312 |
x-1/2,y+1/2,z |
3_455 |
1 |
1 |
125 |
32.7 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.000 |
28 |
|
[CXS]A:301 |
2 |
1 |
402 |
f |
[CXS]A:301 |
-x+1,y,-z+1 |
2_656 |
2 |
1 |
402 |
32.2 |
2.1 |
0.316 |
0 |
0 |
0 |
0.000 |
29 |
|
[EDO]A:310 |
1 |
1 |
185 |
f |
[EDO]A:307 |
x,y,z |
1_555 |
2 |
1 |
186 |
19.3 |
1.0 |
0.707 |
0 |
0 |
0 |
0.000 |
30 |
|
[EDO]A:308 |
3 |
1 |
186 |
f |
[SO4]A:302 |
x,y,z |
1_555 |
3 |
1 |
185 |
17.1 |
-1.7 |
0.996 |
0 |
0 |
0 |
0.017 |
31 |
|
A |
1 |
1 |
12920 |
x |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
3 |
1 |
12920 |
17.0 |
0.1 |
0.329 |
0 |
0 |
0 |
0.000 |
32 |
|
A |
4 |
2 |
12920 |
◊ |
[EDO]A:308 |
x-1/2,y+1/2,z |
3_455 |
1 |
1 |
186 |
16.9 |
-0.0 |
0.653 |
0 |
0 |
0 |
0.000 |
33 |
|
[EDO]A:310 |
2 |
1 |
185 |
◊ |
[EDO]A:308 |
x-1/2,y+1/2,z |
3_455 |
2 |
1 |
186 |
12.1 |
0.4 |
1.000 |
0 |
0 |
0 |
0.000 |
34 |
|
[EDO]A:309 |
2 |
1 |
184 |
f |
[EDO]A:309 |
-x+1,y,-z+1 |
2_656 |
2 |
1 |
184 |
8.2 |
0.4 |
1.000 |
0 |
0 |
0 |
0.000 |
35 |
|
[CL]A:312 |
1 |
1 |
125 |
f |
[SO4]A:302 |
x,y,z |
1_555 |
3 |
1 |
185 |
7.1 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.015 |
36 |
|
[CL]A:312 |
1 |
1 |
125 |
f |
[SO4]A:303 |
x,y,z |
1_555 |
1 |
1 |
185 |
4.9 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.011 |
37 |
|
[CL]A:314 |
1 |
1 |
125 |
f |
[SO4]A:305 |
x,y,z |
1_555 |
1 |
1 |
186 |
3.6 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.008 |
38 |
|
[EDO]A:310 |
1 |
1 |
185 |
◊ |
[SO4]A:302 |
x-1/2,y+1/2,z |
3_455 |
1 |
1 |
185 |
1.9 |
-0.2 |
1.000 |
0 |
0 |
0 |
0.000 |
|