## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
1 |
|
C |
64 |
14 |
5583 |
◊ |
A |
x,y,z |
1_555 |
63 |
14 |
5440 |
611.4 |
-7.5 |
0.232 |
4 |
0 |
0 |
0.648 |
2 |
|
E |
55 |
13 |
5558 |
◊ |
E |
x,-y,-z |
4_555 |
55 |
13 |
5558 |
579.7 |
-10.9 |
0.053 |
4 |
0 |
0 |
0.648 |
Average: |
595.5 |
-9.2 |
0.143 |
4 |
0 |
0 |
0.648 |
2 |
3 |
|
D |
52 |
8 |
1350 |
◊ |
C |
x,y,z |
1_555 |
70 |
17 |
5583 |
572.5 |
-9.2 |
0.213 |
6 |
0 |
0 |
1.000 |
4 |
|
B |
51 |
9 |
1399 |
◊ |
A |
x,y,z |
1_555 |
69 |
18 |
5440 |
566.3 |
-9.9 |
0.152 |
6 |
0 |
0 |
1.000 |
5 |
|
F |
52 |
8 |
1316 |
◊ |
E |
x,y,z |
1_555 |
68 |
18 |
5558 |
545.1 |
-9.5 |
0.168 |
4 |
0 |
0 |
1.000 |
Average: |
561.3 |
-9.5 |
0.177 |
5 |
0 |
0 |
1.000 |
3 |
6 |
|
A |
42 |
10 |
5440 |
x |
A |
-x+1/2,-y-1/2,z-1/2 |
6_544 |
45 |
13 |
5440 |
406.8 |
-0.5 |
0.620 |
2 |
2 |
0 |
0.000 |
4 |
7 |
|
C |
29 |
10 |
5583 |
◊ |
C |
-x+1,y,-z+1/2 |
3_655 |
29 |
10 |
5583 |
290.4 |
-5.2 |
0.184 |
2 |
0 |
0 |
0.000 |
5 |
8 |
|
A |
35 |
11 |
5440 |
◊ |
A |
-x,y,-z-1/2 |
3_554 |
35 |
11 |
5440 |
288.1 |
-1.1 |
0.556 |
4 |
0 |
0 |
0.000 |
6 |
9 |
|
E |
30 |
9 |
5558 |
◊ |
C |
x,y,z |
1_555 |
35 |
11 |
5583 |
276.6 |
-3.2 |
0.350 |
0 |
0 |
0 |
0.000 |
7 |
10 |
|
C |
15 |
4 |
5583 |
◊ |
C |
-x+1,y,-z-1/2 |
3_654 |
15 |
4 |
5583 |
173.4 |
-1.6 |
0.422 |
0 |
0 |
0 |
0.000 |
8 |
11 |
|
F |
17 |
4 |
1316 |
◊ |
C |
x,y,z |
1_555 |
24 |
7 |
5583 |
163.0 |
0.5 |
0.692 |
4 |
0 |
0 |
0.000 |
9 |
12 |
|
D |
14 |
4 |
1350 |
◊ |
A |
x,y,z |
1_555 |
15 |
5 |
5440 |
120.9 |
1.1 |
0.792 |
4 |
0 |
0 |
0.087 |
13 |
|
B |
15 |
4 |
1399 |
◊ |
C |
x,y,z |
1_555 |
16 |
5 |
5583 |
120.5 |
0.6 |
0.718 |
6 |
0 |
0 |
0.087 |
14 |
|
F |
15 |
4 |
1316 |
◊ |
E |
x,-y,-z |
4_555 |
19 |
6 |
5558 |
119.3 |
0.2 |
0.691 |
5 |
0 |
0 |
0.087 |
Average: |
120.2 |
0.7 |
0.734 |
5 |
0 |
0 |
0.087 |
10 |
15 |
|
[GOL]E:3968 |
6 |
1 |
223 |
f |
E |
x,y,z |
1_555 |
14 |
5 |
5558 |
110.1 |
-1.3 |
0.405 |
3 |
0 |
0 |
0.267 |
11 |
16 |
|
E |
9 |
5 |
5558 |
◊ |
E |
x,-y,-z-1 |
4_554 |
9 |
5 |
5558 |
100.4 |
-1.2 |
0.417 |
0 |
0 |
0 |
0.000 |
12 |
17 |
|
E |
8 |
2 |
5558 |
◊ |
E |
-x,y,-z-1/2 |
3_554 |
8 |
2 |
5558 |
91.5 |
-2.9 |
0.101 |
0 |
0 |
0 |
0.000 |
13 |
18 |
|
A |
8 |
2 |
5440 |
◊ |
C |
x-1/2,-y-1/2,-z |
8_445 |
8 |
4 |
5583 |
76.9 |
0.3 |
0.634 |
0 |
0 |
0 |
0.000 |
14 |
19 |
|
A |
5 |
1 |
5440 |
◊ |
D |
-x+1/2,-y-1/2,z-1/2 |
6_544 |
7 |
2 |
1350 |
63.7 |
-0.2 |
0.543 |
0 |
0 |
0 |
0.000 |
15 |
20 |
|
A |
6 |
4 |
5440 |
◊ |
[SO4]A:1 |
-x+1/2,-y-1/2,z-1/2 |
6_544 |
5 |
1 |
186 |
63.6 |
-6.9 |
0.894 |
1 |
0 |
0 |
0.000 |
16 |
21 |
|
[GOL]E:3968 |
5 |
1 |
223 |
◊ |
E |
x,-y,-z |
4_555 |
9 |
3 |
5558 |
58.8 |
0.1 |
0.582 |
2 |
0 |
0 |
0.085 |
17 |
22 |
|
[SO4]A:1 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
7 |
5 |
5440 |
55.6 |
-7.4 |
0.782 |
0 |
0 |
0 |
0.308 |
18 |
23 |
|
D |
7 |
3 |
1350 |
◊ |
C |
-x+1,y,-z+1/2 |
3_655 |
4 |
1 |
5583 |
36.5 |
0.1 |
0.692 |
0 |
0 |
0 |
0.000 |
19 |
24 |
|
D |
4 |
1 |
1350 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
1399 |
35.1 |
0.9 |
0.845 |
0 |
0 |
0 |
0.000 |
20 |
25 |
|
A |
6 |
4 |
5440 |
f |
[CL]C:1 |
-x+1/2,-y-1/2,z-1/2 |
6_544 |
1 |
1 |
125 |
32.9 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.124 |
21 |
26 |
|
[CL]C:1 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
5583 |
27.5 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.000 |
22 |
27 |
|
C |
2 |
1 |
5583 |
◊ |
A |
-x+1/2,-y-1/2,z-1/2 |
6_544 |
2 |
1 |
5440 |
25.5 |
0.6 |
0.453 |
0 |
0 |
0 |
0.000 |
23 |
28 |
|
E |
4 |
3 |
5558 |
◊ |
E |
-x+1,y,-z-1/2 |
3_654 |
4 |
3 |
5558 |
23.3 |
0.8 |
0.809 |
0 |
0 |
0 |
0.000 |
24 |
29 |
|
F |
5 |
2 |
1316 |
◊ |
E |
-x+1,y,-z-1/2 |
3_654 |
3 |
1 |
5558 |
19.7 |
0.8 |
0.808 |
0 |
0 |
0 |
0.000 |
25 |
30 |
|
[CL]C:1 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
5440 |
18.9 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
26 |
31 |
|
[SO4]A:1 |
1 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
1399 |
11.2 |
-1.2 |
0.792 |
0 |
0 |
0 |
0.051 |
27 |
32 |
|
E |
2 |
1 |
5558 |
◊ |
C |
x,-y,-z |
4_555 |
2 |
1 |
5583 |
10.0 |
0.3 |
0.772 |
0 |
0 |
0 |
0.000 |
28 |
33 |
|
E |
1 |
1 |
5558 |
◊ |
C |
-x+1,y,-z-1/2 |
3_654 |
2 |
1 |
5583 |
6.4 |
0.3 |
0.827 |
0 |
0 |
0 |
0.000 |
29 |
34 |
|
A |
1 |
1 |
5440 |
◊ |
C |
-x+1/2,-y-1/2,z-1/2 |
6_544 |
1 |
1 |
5583 |
4.2 |
0.1 |
0.599 |
0 |
0 |
0 |
0.000 |
30 |
35 |
|
E |
1 |
1 |
5558 |
◊ |
C |
x,y,z-1 |
1_554 |
1 |
1 |
5583 |
2.3 |
0.1 |
0.794 |
0 |
0 |
0 |
0.000 |
|