## |
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 |
|
I |
62 |
15 |
3945 |
◊ |
E |
x,y,z |
1_555 |
96 |
30 |
9213 |
689.1 |
-7.8 |
0.245 |
12 |
2 |
0 |
0.108 |
2 |
|
I |
39 |
10 |
3945 |
◊ |
E |
-x,-y+2,z |
2_575 |
36 |
13 |
9213 |
363.5 |
-1.5 |
0.540 |
6 |
2 |
0 |
0.036 |
3 |
|
I |
33 |
13 |
3945 |
◊ |
I |
x,-y+2,-z |
4_575 |
33 |
13 |
3945 |
355.0 |
-5.6 |
0.232 |
3 |
0 |
0 |
0.066 |
4 |
|
E |
33 |
10 |
9213 |
x |
E |
x-1/2,-y+3/2,-z+1/2 |
8_465 |
37 |
14 |
9213 |
346.3 |
-1.4 |
0.321 |
4 |
0 |
0 |
0.000 |
5 |
|
E |
20 |
5 |
9213 |
◊ |
E |
-x,y,-z |
3_555 |
21 |
5 |
9213 |
171.6 |
-3.8 |
0.105 |
0 |
0 |
0 |
0.012 |
6 |
|
I |
16 |
6 |
3945 |
◊ |
E |
x,-y+2,-z |
4_575 |
22 |
6 |
9213 |
166.9 |
-2.3 |
0.328 |
0 |
0 |
0 |
0.017 |
7 |
|
[EDO]E:1 |
4 |
1 |
184 |
f |
E |
x,y,z |
1_555 |
17 |
7 |
9213 |
111.3 |
3.9 |
0.664 |
5 |
0 |
0 |
0.000 |
8 |
|
[EDO]E:2 |
4 |
1 |
187 |
◊ |
E |
x,y,z |
1_555 |
14 |
7 |
9213 |
107.6 |
3.4 |
0.511 |
3 |
0 |
0 |
0.000 |
9 |
|
[SO4]I:1005 |
5 |
1 |
186 |
f |
I |
x,y,z |
1_555 |
16 |
5 |
3945 |
100.9 |
-15.7 |
0.722 |
3 |
0 |
0 |
0.324 |
10 |
|
[EDO]E:3 |
4 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
14 |
7 |
9213 |
98.8 |
2.8 |
0.401 |
2 |
0 |
0 |
0.000 |
11 |
|
[EDO]E:6 |
4 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
14 |
5 |
9213 |
96.4 |
2.6 |
0.376 |
1 |
0 |
0 |
0.000 |
12 |
|
[EDO]E:5 |
4 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
13 |
5 |
9213 |
83.2 |
2.2 |
0.250 |
2 |
0 |
0 |
0.000 |
13 |
|
[EDO]E:4 |
4 |
1 |
186 |
f |
E |
x,y,z |
1_555 |
14 |
7 |
9213 |
82.5 |
2.2 |
0.286 |
2 |
0 |
0 |
0.000 |
14 |
|
[SO4]I:1004 |
5 |
1 |
186 |
f |
I |
x,y,z |
1_555 |
11 |
7 |
3945 |
81.0 |
-11.1 |
0.843 |
3 |
0 |
0 |
0.236 |
15 |
|
[SO4]E:1009 |
5 |
1 |
186 |
f |
E |
x,y,z |
1_555 |
12 |
4 |
9213 |
80.1 |
-11.3 |
0.619 |
1 |
0 |
0 |
0.096 |
16 |
|
[SO4]E:1011 |
5 |
1 |
187 |
f |
E |
x,y,z |
1_555 |
11 |
6 |
9213 |
79.2 |
-11.1 |
0.829 |
4 |
0 |
0 |
0.105 |
17 |
|
[SO4]I:1007 |
5 |
1 |
187 |
f |
I |
x,y,z |
1_555 |
13 |
4 |
3945 |
74.4 |
-11.1 |
0.751 |
2 |
0 |
0 |
0.227 |
18 |
|
[SO4]E:1010 |
5 |
1 |
186 |
f |
E |
x-1/2,-y+3/2,-z+1/2 |
8_465 |
8 |
3 |
9213 |
68.2 |
-9.8 |
0.534 |
2 |
0 |
0 |
0.086 |
19 |
|
[SO4]E:1008 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
9 |
3 |
9213 |
66.6 |
-8.9 |
0.810 |
2 |
0 |
0 |
0.079 |
20 |
|
[SO4]I:1006 |
5 |
1 |
186 |
f |
E |
-x,-y+2,z |
2_575 |
9 |
4 |
9213 |
65.5 |
-8.6 |
0.864 |
1 |
0 |
0 |
0.073 |
21 |
|
[NA]E:1001 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
7 |
5 |
9213 |
63.3 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.073 |
22 |
|
[SO4]I:1006 |
5 |
1 |
186 |
◊ |
I |
x,y,z |
1_555 |
7 |
4 |
3945 |
51.8 |
-5.6 |
0.909 |
2 |
0 |
0 |
0.053 |
23 |
|
[SO4]E:1008 |
4 |
1 |
185 |
◊ |
I |
x,y,z |
1_555 |
6 |
2 |
3945 |
49.0 |
-5.0 |
0.912 |
1 |
0 |
0 |
0.043 |
24 |
|
[SO4]E:1010 |
4 |
1 |
186 |
◊ |
E |
x,y,z |
1_555 |
5 |
3 |
9213 |
44.2 |
-4.7 |
0.957 |
1 |
0 |
0 |
0.000 |
25 |
|
[CA]E:1002 |
1 |
1 |
85 |
f |
E |
x,y,z |
1_555 |
9 |
7 |
9213 |
43.6 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.101 |
26 |
|
[CA]I:1003 |
1 |
1 |
85 |
x |
I |
x,y,z |
1_555 |
8 |
2 |
3945 |
38.9 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.158 |
27 |
|
[SO4]E:1008 |
4 |
1 |
185 |
◊ |
I |
-x,-y+2,z |
2_575 |
4 |
2 |
3945 |
34.0 |
-3.6 |
0.900 |
1 |
0 |
0 |
0.033 |
28 |
|
I |
4 |
1 |
3945 |
◊ |
I |
-x,y,-z |
3_555 |
4 |
1 |
3945 |
27.8 |
-0.5 |
0.477 |
0 |
0 |
0 |
0.002 |
29 |
|
[SO4]E:1008 |
1 |
1 |
185 |
◊ |
[SO4]E:1008 |
-x,-y+2,z |
2_575 |
1 |
1 |
185 |
20.4 |
-4.9 |
0.800 |
0 |
0 |
0 |
0.017 |
30 |
|
[EDO]E:2 |
1 |
1 |
187 |
f |
I |
x,y,z |
1_555 |
1 |
1 |
3945 |
15.9 |
0.5 |
0.967 |
0 |
0 |
0 |
0.000 |
31 |
|
I |
2 |
1 |
3945 |
◊ |
I |
-x,-y+2,z |
2_575 |
2 |
1 |
3945 |
12.5 |
0.8 |
0.895 |
0 |
0 |
0 |
0.000 |
32 |
|
[SO4]I:1006 |
1 |
1 |
186 |
◊ |
[SO4]E:1010 |
-x,-y+2,z |
2_575 |
1 |
1 |
186 |
2.9 |
-0.7 |
1.000 |
0 |
0 |
0 |
0.000 |
33 |
|
[SO4]I:1006 |
1 |
1 |
186 |
◊ |
[SO4]I:1005 |
x,y,z |
1_555 |
1 |
1 |
186 |
0.4 |
-0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
|