## |
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 |
|
D |
68 |
20 |
7577 |
◊ |
C |
x,y,z |
1_555 |
71 |
19 |
7744 |
653.5 |
-11.5 |
0.059 |
5 |
0 |
0 |
0.248 |
2 |
|
B |
68 |
20 |
7655 |
◊ |
A |
x,y,z |
1_555 |
70 |
19 |
7797 |
651.5 |
-11.1 |
0.077 |
4 |
0 |
0 |
0.248 |
Average: |
652.5 |
-11.3 |
0.068 |
5 |
0 |
0 |
0.248 |
2 |
3 |
|
D |
44 |
15 |
7577 |
◊ |
A |
x,y,z |
1_555 |
39 |
15 |
7797 |
384.9 |
-0.6 |
0.529 |
5 |
6 |
0 |
0.006 |
4 |
|
C |
41 |
14 |
7744 |
◊ |
B |
x,y,z |
1_555 |
46 |
14 |
7655 |
375.1 |
-0.9 |
0.549 |
4 |
8 |
0 |
0.006 |
Average: |
380.0 |
-0.8 |
0.539 |
5 |
7 |
0 |
0.006 |
3 |
5 |
|
B |
30 |
8 |
7655 |
◊ |
C |
-x-1,y-1/2,-z |
2_445 |
30 |
8 |
7744 |
311.5 |
2.7 |
0.849 |
6 |
8 |
0 |
0.015 |
4 |
6 |
|
A |
31 |
12 |
7797 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
34 |
13 |
7744 |
266.0 |
-2.2 |
0.401 |
0 |
1 |
0 |
0.000 |
5 |
7 |
|
D |
24 |
7 |
7577 |
◊ |
B |
x,y,z |
1_555 |
26 |
7 |
7655 |
261.0 |
2.2 |
0.824 |
6 |
0 |
0 |
0.004 |
6 |
8 |
|
A |
22 |
6 |
7797 |
◊ |
D |
-x,y-1/2,-z+1 |
2_546 |
21 |
6 |
7577 |
238.6 |
0.8 |
0.722 |
6 |
10 |
0 |
0.033 |
7 |
9 |
|
B |
13 |
7 |
7655 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
16 |
5 |
7577 |
138.4 |
-2.2 |
0.276 |
0 |
0 |
0 |
0.000 |
8 |
10 |
|
A |
16 |
7 |
7797 |
◊ |
C |
x,y-1,z |
1_545 |
11 |
2 |
7744 |
114.2 |
0.9 |
0.732 |
1 |
0 |
0 |
0.000 |
9 |
11 |
|
[SO4]D:991 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
18 |
8 |
7577 |
112.5 |
-18.4 |
0.520 |
3 |
0 |
0 |
0.275 |
10 |
12 |
|
A |
11 |
4 |
7797 |
◊ |
D |
x,y-1,z |
1_545 |
15 |
7 |
7577 |
107.0 |
1.0 |
0.734 |
1 |
2 |
0 |
0.000 |
11 |
13 |
|
B |
8 |
5 |
7655 |
◊ |
C |
x,y-1,z |
1_545 |
7 |
3 |
7744 |
78.0 |
2.1 |
0.889 |
2 |
1 |
0 |
0.000 |
12 |
14 |
|
[ACE]D:0 |
3 |
1 |
174 |
cf |
D |
x,y,z |
1_555 |
6 |
4 |
7577 |
73.9 |
-1.2 |
0.690 |
0 |
0 |
0 |
0.016 |
13 |
15 |
|
[ACE]B:0 |
3 |
1 |
172 |
cf |
B |
x,y,z |
1_555 |
6 |
4 |
7655 |
66.1 |
-0.7 |
0.680 |
0 |
0 |
0 |
0.013 |
14 |
16 |
|
A |
9 |
4 |
7797 |
◊ |
[ZN]D:156 |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
98 |
47.8 |
-27.1 |
0.000 |
0 |
0 |
0 |
0.520 |
17 |
|
[ZN]A:156 |
1 |
1 |
98 |
◊ |
D |
-x,y-1/2,-z+1 |
2_546 |
9 |
4 |
7577 |
46.4 |
-26.6 |
0.000 |
0 |
0 |
0 |
0.520 |
Average: |
47.1 |
-26.9 |
0.000 |
0 |
0 |
0 |
0.520 |
15 |
18 |
|
[ZN]B:156 |
1 |
1 |
98 |
f |
C |
-x-1,y-1/2,-z |
2_445 |
10 |
5 |
7744 |
46.8 |
-24.9 |
0.000 |
0 |
0 |
0 |
0.648 |
19 |
|
B |
9 |
5 |
7655 |
f |
[ZN]C:156 |
-x-1,y-1/2,-z |
2_445 |
1 |
1 |
98 |
43.3 |
-25.5 |
0.000 |
0 |
0 |
0 |
0.648 |
Average: |
45.1 |
-25.2 |
0.000 |
0 |
0 |
0 |
0.648 |
16 |
20 |
|
A |
6 |
3 |
7797 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
6 |
2 |
7655 |
41.9 |
0.7 |
0.699 |
0 |
0 |
0 |
0.000 |
17 |
21 |
|
[ZN]A:156 |
1 |
1 |
98 |
cf |
A |
x,y,z |
1_555 |
3 |
1 |
7797 |
31.6 |
-12.9 |
0.000 |
0 |
0 |
0 |
0.248 |
22 |
|
[ZN]D:156 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
3 |
1 |
7577 |
30.2 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.248 |
Average: |
30.9 |
-12.6 |
0.000 |
0 |
0 |
0 |
0.248 |
18 |
23 |
|
[ZN]C:156 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
7744 |
30.8 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.328 |
24 |
|
[ZN]B:156 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
7655 |
30.4 |
-13.1 |
0.000 |
0 |
0 |
0 |
0.328 |
Average: |
30.6 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.328 |
19 |
25 |
|
D |
3 |
1 |
7577 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
4 |
2 |
7744 |
21.8 |
0.3 |
0.732 |
0 |
0 |
0 |
0.000 |
20 |
26 |
|
B |
1 |
1 |
7655 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
1 |
1 |
7744 |
3.2 |
0.2 |
0.769 |
0 |
0 |
0 |
0.000 |
21 |
27 |
|
[ACE]D:0 |
1 |
1 |
174 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
7655 |
1.9 |
-0.1 |
0.550 |
0 |
0 |
0 |
0.000 |
|