| ## |
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 |
138 |
32 |
11104 |
◊ |
A |
x,y,z |
1_555 |
131 |
32 |
11088 |
1272.3 |
-20.8 |
0.064 |
13 |
10 |
0 |
0.338 |
| 2 |
2 |
|
A |
30 |
7 |
11088 |
x |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
43 |
10 |
11088 |
343.8 |
-1.7 |
0.603 |
3 |
5 |
0 |
0.000 |
| 3 |
3 |
|
[GSH]B:301 |
18 |
1 |
504 |
f |
B |
x,y,z |
1_555 |
36 |
14 |
11104 |
267.7 |
-1.9 |
0.772 |
8 |
0 |
0 |
0.127 |
4 |
|
[GSH]A:301 |
17 |
1 |
495 |
f |
A |
x,y,z |
1_555 |
33 |
13 |
11088 |
261.4 |
-1.5 |
0.787 |
8 |
0 |
0 |
0.127 |
| Average: |
264.6 |
-1.7 |
0.780 |
8 |
0 |
0 |
0.127 |
| 4 |
5 |
|
[MES]B:303 |
11 |
1 |
337 |
f |
B |
x,y,z |
1_555 |
24 |
8 |
11104 |
156.6 |
3.2 |
0.131 |
0 |
0 |
0 |
0.000 |
| 5 |
6 |
|
[MES]A:303 |
12 |
1 |
337 |
f |
A |
x,y,z |
1_555 |
24 |
8 |
11088 |
156.1 |
3.2 |
0.093 |
0 |
0 |
0 |
0.000 |
| 6 |
7 |
|
A |
13 |
3 |
11088 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
19 |
6 |
11088 |
136.6 |
1.1 |
0.792 |
1 |
2 |
0 |
0.000 |
| 7 |
8 |
|
B |
18 |
4 |
11104 |
x |
B |
x-1/2,-y+1/2,-z |
4_455 |
15 |
4 |
11104 |
135.9 |
1.4 |
0.804 |
2 |
2 |
0 |
0.000 |
| 8 |
9 |
|
B |
6 |
2 |
11104 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
10 |
3 |
11088 |
67.1 |
0.5 |
0.716 |
1 |
0 |
0 |
0.000 |
| 9 |
10 |
|
[GSH]B:301 |
4 |
1 |
504 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
11088 |
42.0 |
0.2 |
0.712 |
2 |
0 |
0 |
0.017 |
11 |
|
[GSH]A:301 |
4 |
1 |
495 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
11104 |
41.4 |
0.2 |
0.724 |
2 |
0 |
0 |
0.017 |
| Average: |
41.7 |
0.2 |
0.718 |
2 |
0 |
0 |
0.017 |
| 10 |
12 |
|
[ZN]A:302 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
11088 |
41.3 |
-24.6 |
0.000 |
0 |
0 |
0 |
0.591 |
13 |
|
[ZN]B:302 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
11104 |
40.3 |
-24.3 |
0.000 |
0 |
0 |
0 |
0.591 |
| Average: |
40.8 |
-24.5 |
0.000 |
0 |
0 |
0 |
0.591 |
| 11 |
14 |
|
B |
6 |
3 |
11104 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
6 |
3 |
11088 |
36.8 |
0.8 |
0.812 |
1 |
1 |
0 |
0.000 |
| 12 |
15 |
|
[ZN]B:302 |
1 |
1 |
98 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
3 |
1 |
11104 |
33.0 |
-14.4 |
0.000 |
0 |
0 |
0 |
0.000 |
16 |
|
A |
3 |
1 |
11088 |
◊ |
[ZN]A:302 |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
98 |
32.8 |
-14.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
32.9 |
-14.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| 13 |
17 |
|
B |
3 |
2 |
11104 |
x |
B |
x-1/2,-y-1/2,-z |
4_445 |
2 |
2 |
11104 |
4.0 |
-0.1 |
0.547 |
0 |
0 |
0 |
0.000 |
| 14 |
18 |
|
A |
1 |
1 |
11088 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
11104 |
2.5 |
-0.1 |
0.419 |
0 |
0 |
0 |
0.000 |
| 15 |
19 |
|
[MES]B:303 |
1 |
1 |
337 |
f |
[ZN]B:302 |
x,y,z |
1_555 |
1 |
1 |
98 |
0.9 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.004 |
| 16 |
20 |
|
A |
1 |
1 |
11088 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
2 |
1 |
11104 |
0.6 |
-0.0 |
0.590 |
0 |
0 |
0 |
0.000 |
|