| ## |
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 |
338 |
81 |
9605 |
◊ |
A |
x,y,z |
1_555 |
339 |
83 |
9594 |
3189.4 |
-54.6 |
0.030 |
30 |
12 |
0 |
0.406 |
| 2 |
2 |
|
A |
49 |
16 |
9594 |
◊ |
B |
-y+2,x-y+2,z |
2_775 |
51 |
16 |
9605 |
460.4 |
-2.6 |
0.631 |
1 |
1 |
0 |
0.018 |
| 3 |
3 |
|
B |
26 |
7 |
9605 |
x |
B |
-y+2,x-y+2,z |
2_775 |
34 |
8 |
9605 |
237.4 |
-2.3 |
0.550 |
3 |
0 |
0 |
0.036 |
4 |
|
A |
34 |
9 |
9594 |
x |
A |
-y+2,x-y+2,z |
2_775 |
23 |
7 |
9594 |
221.4 |
-1.7 |
0.616 |
2 |
1 |
0 |
0.036 |
| Average: |
229.4 |
-2.0 |
0.583 |
3 |
1 |
0 |
0.036 |
| 4 |
5 |
|
B |
19 |
7 |
9605 |
◊ |
A |
-x+1,-y+2,z-1/2 |
4_674 |
25 |
8 |
9594 |
210.5 |
-2.8 |
0.426 |
0 |
0 |
0 |
0.000 |
| 5 |
6 |
|
A |
16 |
4 |
9594 |
x |
A |
-y+2,x-y+1,z |
2_765 |
9 |
4 |
9594 |
112.3 |
-0.8 |
0.538 |
0 |
0 |
0 |
0.000 |
| 6 |
7 |
|
[FE]B:404 |
1 |
1 |
137 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
9605 |
38.5 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.073 |
8 |
|
[FE]A:401 |
1 |
1 |
137 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
9594 |
38.3 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.073 |
| Average: |
38.4 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.073 |
| 7 |
9 |
|
[FE]B:404 |
1 |
1 |
137 |
◊ |
A |
x,y,z |
1_555 |
13 |
7 |
9594 |
35.7 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.051 |
10 |
|
[FE]A:401 |
1 |
1 |
137 |
◊ |
B |
x,y,z |
1_555 |
12 |
7 |
9605 |
35.4 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.051 |
| Average: |
35.5 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.051 |
| 8 |
11 |
|
[OXY]A:406 |
2 |
1 |
120 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
9594 |
34.4 |
0.7 |
0.890 |
0 |
0 |
0 |
0.000 |
| 9 |
12 |
|
[OXY]B:403 |
2 |
1 |
121 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
9605 |
33.4 |
0.7 |
0.888 |
0 |
0 |
0 |
0.000 |
| 10 |
13 |
|
B |
4 |
1 |
9605 |
◊ |
A |
-y+2,x-y+1,z |
2_765 |
5 |
2 |
9594 |
32.9 |
-0.6 |
0.462 |
0 |
0 |
0 |
0.000 |
| 11 |
14 |
|
[OXY]B:403 |
2 |
1 |
121 |
◊ |
A |
x,y,z |
1_555 |
11 |
6 |
9594 |
31.4 |
0.6 |
0.873 |
0 |
0 |
0 |
0.000 |
| 12 |
15 |
|
[OXY]A:406 |
2 |
1 |
120 |
◊ |
B |
x,y,z |
1_555 |
11 |
6 |
9605 |
31.4 |
0.5 |
0.866 |
0 |
0 |
0 |
0.000 |
| 13 |
16 |
|
[ZN]A:405 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
9594 |
26.0 |
-17.5 |
0.000 |
0 |
0 |
0 |
0.204 |
17 |
|
[ZN]B:402 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
9605 |
25.8 |
-17.6 |
0.000 |
0 |
0 |
0 |
0.204 |
| Average: |
25.9 |
-17.6 |
0.000 |
0 |
0 |
0 |
0.204 |
| 14 |
18 |
|
[ZN]B:402 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
7 |
4 |
9594 |
22.7 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.131 |
19 |
|
[ZN]A:405 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
6 |
4 |
9605 |
22.0 |
-11.1 |
0.000 |
0 |
0 |
0 |
0.131 |
| Average: |
22.4 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.131 |
| 15 |
20 |
|
[OXY]B:403 |
2 |
1 |
121 |
◊ |
[FE]A:401 |
x,y,z |
1_555 |
1 |
1 |
137 |
20.9 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.020 |
21 |
|
[OXY]A:406 |
2 |
1 |
120 |
◊ |
[FE]B:404 |
x,y,z |
1_555 |
1 |
1 |
137 |
20.0 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.020 |
| Average: |
20.4 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.020 |
| 16 |
22 |
|
B |
5 |
2 |
9605 |
◊ |
A |
-y+1,x-y+1,z |
2_665 |
3 |
1 |
9594 |
19.4 |
0.4 |
0.744 |
0 |
0 |
0 |
0.000 |
| 17 |
23 |
|
[OXY]A:406 |
2 |
1 |
120 |
f |
[ZN]A:405 |
x,y,z |
1_555 |
1 |
1 |
98 |
14.5 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.064 |
24 |
|
[OXY]B:403 |
2 |
1 |
121 |
f |
[ZN]B:402 |
x,y,z |
1_555 |
1 |
1 |
98 |
13.4 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.064 |
| Average: |
13.9 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.064 |
| 18 |
25 |
|
[ZN]A:405 |
1 |
1 |
98 |
◊ |
[FE]B:404 |
x,y,z |
1_555 |
1 |
1 |
137 |
11.2 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.033 |
| 19 |
26 |
|
[ZN]B:402 |
1 |
1 |
98 |
◊ |
[FE]A:401 |
x,y,z |
1_555 |
1 |
1 |
137 |
11.2 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.033 |
| 20 |
27 |
|
B |
1 |
1 |
9605 |
x |
B |
-y+2,x-y+1,z |
2_765 |
1 |
1 |
9605 |
4.7 |
0.1 |
0.804 |
0 |
0 |
0 |
0.000 |
|