## |
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 |
101 |
32 |
20536 |
◊ |
A |
x-1/2,-y+3/2,-z+1 |
4_466 |
104 |
33 |
19683 |
999.2 |
-12.4 |
0.089 |
11 |
0 |
0 |
0.135 |
2 |
2 |
|
B |
76 |
17 |
20536 |
◊ |
A |
x,y,z |
1_555 |
86 |
24 |
19683 |
706.8 |
-3.9 |
0.356 |
7 |
2 |
0 |
0.000 |
3 |
3 |
|
B |
68 |
18 |
20536 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
73 |
20 |
19683 |
672.8 |
4.2 |
0.900 |
15 |
8 |
0 |
0.000 |
4 |
4 |
|
B |
22 |
4 |
20536 |
◊ |
A |
x-1,y,z |
1_455 |
34 |
12 |
19683 |
245.2 |
-0.8 |
0.525 |
2 |
2 |
0 |
0.000 |
5 |
5 |
|
B |
21 |
7 |
20536 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
16 |
5 |
20536 |
161.7 |
-0.1 |
0.644 |
3 |
0 |
0 |
0.000 |
6 |
6 |
|
[CAC]A:704 |
5 |
1 |
232 |
f |
A |
x,y,z |
1_555 |
25 |
14 |
19683 |
132.0 |
2.5 |
0.325 |
0 |
0 |
0 |
0.000 |
7 |
7 |
|
[CAC]B:705 |
5 |
1 |
232 |
f |
B |
x,y,z |
1_555 |
24 |
13 |
20536 |
129.6 |
2.5 |
0.343 |
0 |
0 |
0 |
0.000 |
8 |
8 |
|
[ACT]A:703 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
24 |
12 |
19683 |
114.6 |
-0.9 |
0.576 |
3 |
0 |
0 |
0.018 |
9 |
9 |
|
[ACT]B:704 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
23 |
12 |
20536 |
113.7 |
-0.9 |
0.591 |
3 |
0 |
0 |
0.018 |
10 |
10 |
|
A |
10 |
5 |
19683 |
◊ |
B |
-x+3/2,-y+1,z-1/2 |
2_664 |
12 |
4 |
20536 |
103.6 |
1.7 |
0.837 |
0 |
0 |
0 |
0.000 |
11 |
11 |
|
A |
11 |
5 |
19683 |
x |
A |
-x+2,y-1/2,-z+1/2 |
3_745 |
13 |
3 |
19683 |
92.0 |
-0.6 |
0.393 |
0 |
0 |
0 |
0.000 |
12 |
12 |
|
[FE]B:701 |
1 |
1 |
137 |
f |
B |
x,y,z |
1_555 |
6 |
4 |
20536 |
49.0 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.142 |
13 |
|
[FE]A:701 |
1 |
1 |
137 |
f |
A |
x,y,z |
1_555 |
6 |
4 |
19683 |
49.0 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.142 |
Average: |
49.0 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.142 |
13 |
14 |
|
[CA]B:703 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
20536 |
37.8 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.053 |
14 |
15 |
|
[CAC]A:704 |
3 |
1 |
232 |
cf |
[FE]A:701 |
x,y,z |
1_555 |
1 |
1 |
137 |
36.4 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.040 |
16 |
|
[CAC]B:705 |
4 |
1 |
232 |
f |
[FE]B:701 |
x,y,z |
1_555 |
1 |
1 |
137 |
35.8 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.040 |
Average: |
36.1 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.040 |
15 |
17 |
|
[ZN]B:702 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
4 |
20536 |
31.8 |
-23.9 |
0.000 |
0 |
0 |
0 |
0.369 |
18 |
|
[ZN]A:702 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
4 |
19683 |
31.4 |
-23.5 |
0.000 |
0 |
0 |
0 |
0.369 |
Average: |
31.6 |
-23.7 |
0.000 |
0 |
0 |
0 |
0.369 |
16 |
19 |
|
[CAC]B:705 |
4 |
1 |
232 |
f |
[ZN]B:702 |
x,y,z |
1_555 |
1 |
1 |
98 |
23.4 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.136 |
20 |
|
[CAC]A:704 |
4 |
1 |
232 |
f |
[ZN]A:702 |
x,y,z |
1_555 |
1 |
1 |
98 |
23.3 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.136 |
Average: |
23.4 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.136 |
17 |
21 |
|
A |
2 |
2 |
19683 |
◊ |
B |
-x+3/2,-y+2,z-1/2 |
2_674 |
2 |
1 |
20536 |
17.7 |
0.4 |
0.487 |
0 |
0 |
0 |
0.000 |
18 |
22 |
|
[ZN]A:702 |
1 |
1 |
98 |
f |
[FE]A:701 |
x,y,z |
1_555 |
1 |
1 |
137 |
16.5 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.064 |
19 |
23 |
|
[ZN]B:702 |
1 |
1 |
98 |
f |
[FE]B:701 |
x,y,z |
1_555 |
1 |
1 |
137 |
16.5 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.065 |
|