## |
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 |
|
B |
95 |
31 |
9911 |
◊ |
A |
x,y,z |
1_555 |
99 |
33 |
10003 |
883.8 |
-7.5 |
0.392 |
4 |
4 |
0 |
0.032 |
2 |
2 |
|
A |
34 |
13 |
10003 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
36 |
10 |
9911 |
346.0 |
0.0 |
0.647 |
4 |
0 |
0 |
0.000 |
3 |
3 |
|
A |
39 |
9 |
10003 |
◊ |
B |
x,y-1,z |
1_545 |
44 |
10 |
9911 |
344.8 |
-1.5 |
0.613 |
5 |
0 |
0 |
0.000 |
4 |
4 |
|
A |
36 |
11 |
10003 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
30 |
8 |
9911 |
266.7 |
-4.3 |
0.231 |
0 |
0 |
0 |
0.000 |
5 |
5 |
|
A |
29 |
9 |
10003 |
x |
A |
-x+1/2,-y,z-1/2 |
2_554 |
30 |
9 |
10003 |
263.5 |
-2.5 |
0.421 |
2 |
0 |
0 |
0.000 |
6 |
6 |
|
A |
26 |
10 |
10003 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
28 |
12 |
9911 |
247.9 |
-1.6 |
0.518 |
1 |
0 |
0 |
0.000 |
7 |
7 |
|
[NO9]B:305 |
14 |
1 |
348 |
f |
B |
x,y,z |
1_555 |
30 |
12 |
9911 |
215.4 |
-0.3 |
0.184 |
6 |
0 |
0 |
0.016 |
8 |
|
[NO9]A:607 |
14 |
1 |
347 |
f |
A |
x,y,z |
1_555 |
31 |
12 |
10003 |
209.7 |
0.3 |
0.214 |
5 |
0 |
0 |
0.016 |
Average: |
212.6 |
-0.0 |
0.199 |
6 |
0 |
0 |
0.016 |
8 |
9 |
|
B |
15 |
6 |
9911 |
x |
B |
x-1/2,-y+1/2,-z |
4_455 |
22 |
5 |
9911 |
162.2 |
-1.4 |
0.418 |
2 |
4 |
0 |
0.000 |
9 |
10 |
|
[SO4]A:606 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
21 |
12 |
10003 |
119.5 |
-18.2 |
0.754 |
3 |
0 |
0 |
0.064 |
10 |
11 |
|
[SO4]A:604 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
10003 |
81.0 |
-10.1 |
0.940 |
4 |
0 |
0 |
0.039 |
11 |
12 |
|
[SO4]A:605 |
5 |
1 |
183 |
f |
B |
x-1/2,-y+1/2,-z |
4_455 |
10 |
5 |
9911 |
79.7 |
-9.9 |
0.927 |
2 |
0 |
0 |
0.035 |
12 |
13 |
|
B |
14 |
7 |
9911 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
10 |
4 |
10003 |
79.1 |
-0.4 |
0.591 |
1 |
0 |
0 |
0.000 |
13 |
14 |
|
[SO4]B:304 |
5 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
9911 |
77.6 |
-11.3 |
0.836 |
5 |
0 |
0 |
0.044 |
14 |
15 |
|
B |
8 |
4 |
9911 |
x |
B |
-x+1/2,-y+1,z-1/2 |
2_564 |
9 |
5 |
9911 |
77.2 |
0.9 |
0.790 |
1 |
2 |
0 |
0.000 |
15 |
16 |
|
[SO4]A:605 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
9 |
3 |
10003 |
65.9 |
-8.3 |
0.952 |
2 |
0 |
0 |
0.003 |
16 |
17 |
|
B |
11 |
5 |
9911 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
6 |
4 |
10003 |
53.2 |
0.1 |
0.606 |
0 |
0 |
0 |
0.000 |
17 |
18 |
|
[ZN]B:303 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
2 |
9911 |
40.6 |
-23.4 |
0.000 |
0 |
0 |
0 |
0.158 |
19 |
|
[ZN]A:603 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
5 |
3 |
10003 |
35.0 |
-24.8 |
0.000 |
0 |
0 |
0 |
0.158 |
Average: |
37.8 |
-24.1 |
0.000 |
0 |
0 |
0 |
0.158 |
18 |
20 |
|
A |
3 |
2 |
10003 |
◊ |
[SO4]B:304 |
-x+1,y-1/2,-z+1/2 |
3_645 |
4 |
1 |
183 |
39.4 |
-5.0 |
0.422 |
0 |
0 |
0 |
0.000 |
19 |
21 |
|
[ZN]B:303 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
10003 |
33.3 |
-15.2 |
0.000 |
0 |
0 |
0 |
0.095 |
22 |
|
[ZN]A:603 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
9911 |
31.7 |
-13.9 |
0.000 |
0 |
0 |
0 |
0.095 |
Average: |
32.5 |
-14.6 |
0.000 |
0 |
0 |
0 |
0.095 |
20 |
23 |
|
[ZN]B:301 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
9911 |
31.0 |
-22.8 |
0.000 |
0 |
0 |
0 |
0.151 |
24 |
|
[ZN]A:601 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
10003 |
30.7 |
-23.5 |
0.000 |
0 |
0 |
0 |
0.151 |
Average: |
30.9 |
-23.1 |
0.000 |
0 |
0 |
0 |
0.151 |
21 |
25 |
|
B |
9 |
6 |
9911 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
7 |
4 |
10003 |
30.9 |
0.2 |
0.685 |
0 |
0 |
0 |
0.000 |
22 |
26 |
|
[ZN]B:302 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
9911 |
30.8 |
-21.3 |
0.000 |
0 |
0 |
0 |
0.139 |
27 |
|
[ZN]A:602 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
10003 |
30.6 |
-21.2 |
0.000 |
0 |
0 |
0 |
0.139 |
Average: |
30.7 |
-21.2 |
0.000 |
0 |
0 |
0 |
0.139 |
23 |
28 |
|
[NO9]B:305 |
5 |
1 |
348 |
f |
[ZN]B:302 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.1 |
-14.2 |
0.000 |
0 |
0 |
0 |
0.094 |
29 |
|
[NO9]A:607 |
5 |
1 |
347 |
f |
[ZN]A:602 |
x,y,z |
1_555 |
1 |
1 |
98 |
28.9 |
-14.5 |
0.000 |
0 |
0 |
0 |
0.094 |
Average: |
29.5 |
-14.4 |
0.000 |
0 |
0 |
0 |
0.094 |
24 |
30 |
|
B |
2 |
1 |
9911 |
◊ |
[SO4]A:604 |
-x+1/2,-y+1,z-1/2 |
2_564 |
3 |
1 |
184 |
29.6 |
-3.7 |
0.890 |
1 |
0 |
0 |
0.000 |
25 |
31 |
|
[NO9]B:305 |
4 |
1 |
348 |
f |
[ZN]B:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
29.2 |
-11.9 |
0.000 |
0 |
0 |
0 |
0.078 |
32 |
|
[NO9]A:607 |
4 |
1 |
347 |
f |
[ZN]A:601 |
x,y,z |
1_555 |
1 |
1 |
98 |
27.1 |
-11.9 |
0.000 |
0 |
0 |
0 |
0.078 |
Average: |
28.2 |
-11.9 |
0.000 |
0 |
0 |
0 |
0.078 |
26 |
33 |
|
[NO9]A:607 |
3 |
1 |
347 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
2 |
1 |
9911 |
22.2 |
0.6 |
0.494 |
0 |
0 |
0 |
0.000 |
27 |
34 |
|
[ZN]A:602 |
1 |
1 |
98 |
f |
[ZN]A:601 |
x,y,z |
1_555 |
1 |
1 |
98 |
10.6 |
-8.5 |
0.000 |
0 |
0 |
0 |
0.028 |
28 |
35 |
|
[ZN]B:302 |
1 |
1 |
98 |
f |
[ZN]B:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
10.5 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.028 |
29 |
36 |
|
[SO4]A:605 |
1 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
9911 |
4.8 |
-0.5 |
0.792 |
0 |
0 |
0 |
0.000 |
|