## |
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 |
90 |
25 |
19406 |
x |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
98 |
27 |
19406 |
857.0 |
-10.3 |
0.182 |
7 |
0 |
0 |
0.000 |
2 |
|
B |
80 |
22 |
4642 |
◊ |
A |
x,y,z |
1_555 |
78 |
23 |
19406 |
733.7 |
-8.3 |
0.265 |
8 |
3 |
0 |
0.119 |
3 |
|
A |
45 |
13 |
19406 |
x |
A |
x,y,z-1 |
1_554 |
51 |
14 |
19406 |
430.2 |
-1.8 |
0.543 |
7 |
5 |
0 |
0.000 |
4 |
|
A |
27 |
11 |
19406 |
◊ |
A |
-x,y,-z+1 |
2_556 |
27 |
11 |
19406 |
268.6 |
-3.8 |
0.217 |
0 |
0 |
0 |
0.000 |
5 |
|
[DTT]A:811 |
8 |
1 |
288 |
cf |
A |
x,y,z |
1_555 |
19 |
5 |
19406 |
130.5 |
-2.1 |
0.553 |
6 |
0 |
0 |
0.046 |
6 |
|
B |
13 |
3 |
4642 |
◊ |
A |
-x,y,-z+1 |
2_556 |
10 |
3 |
19406 |
110.1 |
-0.8 |
0.496 |
0 |
0 |
0 |
0.000 |
7 |
|
A |
13 |
5 |
19406 |
f |
[EDO]A:812 |
-x+1/2,y-1/2,-z+1 |
4_546 |
4 |
1 |
184 |
76.3 |
1.6 |
0.735 |
3 |
0 |
0 |
0.000 |
8 |
|
[SO4]A:802 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
19406 |
75.8 |
-9.2 |
0.940 |
4 |
0 |
0 |
0.107 |
9 |
|
[SO4]A:801 |
5 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
19406 |
75.2 |
-10.1 |
0.889 |
5 |
0 |
0 |
0.119 |
10 |
|
[CL]A:808 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
20 |
6 |
19406 |
72.7 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.090 |
11 |
|
[NA]A:804 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
19406 |
67.5 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.089 |
12 |
|
[CL]A:805 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
19406 |
62.1 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.079 |
13 |
|
[EDO]A:812 |
3 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
11 |
4 |
19406 |
60.7 |
1.3 |
0.213 |
0 |
0 |
0 |
0.000 |
14 |
|
[CL]A:806 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
19406 |
59.7 |
-8.0 |
0.000 |
0 |
0 |
0 |
0.078 |
15 |
|
[CL]A:807 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
19406 |
54.8 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.065 |
16 |
|
[CL]A:807 |
1 |
1 |
125 |
◊ |
A |
x,y,z-1 |
1_554 |
12 |
3 |
19406 |
52.8 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.000 |
17 |
|
[NA]A:803 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
19406 |
52.7 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.077 |
18 |
|
[CL]A:809 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
19406 |
49.4 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.063 |
19 |
|
[CL]A:810 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
19406 |
45.0 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.054 |
20 |
|
[SO4]A:801 |
4 |
1 |
183 |
◊ |
A |
x,y,z-1 |
1_554 |
5 |
3 |
19406 |
37.4 |
-4.5 |
0.938 |
1 |
0 |
0 |
0.000 |
21 |
|
[NA]A:803 |
1 |
1 |
125 |
◊ |
A |
x,y,z-1 |
1_554 |
8 |
3 |
19406 |
36.4 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.000 |
22 |
|
[CL]A:808 |
1 |
1 |
125 |
◊ |
A |
x,y,z-1 |
1_554 |
2 |
1 |
19406 |
33.3 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.000 |
23 |
|
A |
3 |
2 |
19406 |
◊ |
B |
-x+1/2,y-1/2,-z+2 |
4_547 |
2 |
1 |
4642 |
16.1 |
0.4 |
0.782 |
0 |
0 |
0 |
0.000 |
24 |
|
A |
2 |
1 |
19406 |
x |
A |
-x+1/2,y-1/2,-z |
4_545 |
3 |
2 |
19406 |
14.6 |
-0.2 |
0.415 |
0 |
0 |
0 |
0.000 |
25 |
|
[CL]A:806 |
1 |
1 |
125 |
f |
[NA]A:804 |
x,y,z |
1_555 |
1 |
1 |
125 |
8.9 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.017 |
26 |
|
A |
1 |
1 |
19406 |
◊ |
B |
x,y,z-1 |
1_554 |
3 |
2 |
4642 |
8.9 |
-0.2 |
0.384 |
0 |
0 |
0 |
0.000 |
27 |
|
A |
1 |
1 |
19406 |
◊ |
[SO4]A:802 |
x,y,z-1 |
1_554 |
1 |
1 |
185 |
1.6 |
-0.2 |
0.859 |
0 |
0 |
0 |
0.000 |
|