## |
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 |
30 |
14736 |
◊ |
A |
-x+y+1,y,-z |
11_655 |
92 |
26 |
14207 |
893.1 |
-2.6 |
0.708 |
15 |
5 |
0 |
0.193 |
2 |
2 |
|
B |
66 |
22 |
14736 |
◊ |
B |
-x+y+1,y,-z |
11_655 |
66 |
22 |
14736 |
691.4 |
-10.3 |
0.115 |
4 |
0 |
0 |
0.242 |
3 |
3 |
|
B |
52 |
19 |
14736 |
◊ |
A |
-y+1,x-y,z-1/3 |
2_654 |
50 |
12 |
14207 |
465.1 |
6.6 |
0.972 |
8 |
7 |
0 |
0.000 |
4 |
4 |
|
B |
54 |
14 |
14736 |
◊ |
B |
x-y,-y,-z |
8_555 |
54 |
14 |
14736 |
438.0 |
-6.1 |
0.289 |
0 |
2 |
0 |
0.128 |
5 |
5 |
|
B |
35 |
11 |
14736 |
◊ |
A |
x,y,z |
1_555 |
48 |
16 |
14207 |
353.4 |
2.0 |
0.808 |
3 |
3 |
0 |
0.000 |
6 |
6 |
|
B |
31 |
10 |
14736 |
◊ |
A |
-y+1,-x+1,-z+2/3 |
10_665 |
19 |
7 |
14207 |
225.2 |
1.2 |
0.811 |
2 |
2 |
0 |
0.000 |
7 |
7 |
|
B |
25 |
6 |
14736 |
◊ |
B |
-y+1,-x+1,-z+2/3 |
10_665 |
25 |
6 |
14736 |
153.9 |
1.1 |
0.804 |
2 |
4 |
0 |
0.000 |
8 |
8 |
|
B |
14 |
7 |
14736 |
◊ |
A |
-x+1,-y,z |
4_655 |
18 |
5 |
14207 |
142.7 |
-1.0 |
0.512 |
1 |
0 |
0 |
0.023 |
9 |
9 |
|
A |
11 |
2 |
14207 |
◊ |
A |
-x+1,-y,z |
4_655 |
11 |
2 |
14207 |
82.0 |
1.7 |
0.873 |
2 |
2 |
0 |
0.000 |
10 |
10 |
|
[NI]B:801 |
1 |
1 |
115 |
f |
A |
-x+y+1,y,-z |
11_655 |
6 |
3 |
14207 |
51.3 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.241 |
11 |
|
[NI]B:805 |
1 |
1 |
115 |
f |
B |
x,y,z |
1_555 |
5 |
3 |
14736 |
43.1 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.241 |
Average: |
47.2 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.241 |
11 |
12 |
|
[NI]B:802 |
1 |
1 |
115 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
14736 |
48.4 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.336 |
13 |
|
[NI]B:803 |
1 |
1 |
115 |
f |
A |
-x+y+1,y,-z |
11_655 |
8 |
4 |
14207 |
47.6 |
-8.0 |
0.000 |
0 |
0 |
0 |
0.336 |
Average: |
48.0 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.336 |
12 |
14 |
|
[NI]B:804 |
1 |
1 |
115 |
◊ |
A |
-x+y+1,y,-z |
11_655 |
7 |
4 |
14207 |
46.2 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.182 |
15 |
|
[NI]B:804 |
1 |
1 |
115 |
◊ |
B |
x,y,z |
1_555 |
10 |
4 |
14736 |
44.7 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.182 |
Average: |
45.5 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.182 |
13 |
16 |
|
A |
7 |
2 |
14207 |
◊ |
A |
-y+1,-x+1,-z+2/3 |
10_665 |
7 |
2 |
14207 |
40.9 |
0.3 |
0.714 |
0 |
0 |
0 |
0.000 |
14 |
17 |
|
[NI]B:805 |
1 |
1 |
115 |
◊ |
A |
-x+y+1,y,-z |
11_655 |
4 |
2 |
14207 |
40.6 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.139 |
18 |
|
[NI]B:801 |
1 |
1 |
115 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
14736 |
39.7 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.139 |
Average: |
40.1 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.139 |
15 |
19 |
|
[NI]B:803 |
1 |
1 |
115 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
14736 |
32.7 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.112 |
20 |
|
[NI]B:802 |
1 |
1 |
115 |
◊ |
A |
-x+y+1,y,-z |
11_655 |
4 |
2 |
14207 |
30.9 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.112 |
Average: |
31.8 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.112 |
16 |
21 |
|
[NI]B:805 |
1 |
1 |
115 |
◊ |
B |
x-y,-y,-z |
8_555 |
6 |
2 |
14736 |
22.4 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.068 |
|