## |
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 |
|
[3A1]B:566 |
42 |
1 |
930 |
f |
B |
x,y,z |
1_555 |
99 |
32 |
22351 |
603.9 |
-4.2 |
0.240 |
8 |
0 |
0 |
0.017 |
2 |
|
[3A1]A:565 |
40 |
1 |
911 |
f |
A |
x,y,z |
1_555 |
98 |
32 |
22395 |
591.6 |
-4.5 |
0.267 |
10 |
0 |
0 |
0.017 |
Average: |
597.8 |
-4.3 |
0.253 |
9 |
0 |
0 |
0.017 |
2 |
3 |
|
B |
65 |
18 |
22351 |
◊ |
A |
x,y,z |
1_555 |
71 |
23 |
22395 |
592.4 |
1.5 |
0.694 |
4 |
2 |
0 |
0.000 |
3 |
4 |
|
A |
48 |
12 |
22395 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
46 |
12 |
22351 |
400.9 |
0.5 |
0.629 |
6 |
4 |
0 |
0.000 |
4 |
5 |
|
A |
44 |
13 |
22395 |
◊ |
B |
x,y,z-1 |
1_554 |
38 |
12 |
22351 |
380.3 |
-0.3 |
0.512 |
2 |
1 |
0 |
0.000 |
5 |
6 |
|
A |
19 |
6 |
22395 |
◊ |
B |
x-1,y,z-1 |
1_454 |
20 |
8 |
22351 |
197.5 |
0.7 |
0.513 |
2 |
0 |
0 |
0.000 |
6 |
7 |
|
A |
25 |
8 |
22395 |
x |
A |
x-1,y,z |
1_455 |
16 |
6 |
22395 |
153.8 |
-1.0 |
0.349 |
0 |
0 |
0 |
0.000 |
7 |
8 |
|
[ACT]B:568 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
18 |
7 |
22351 |
88.9 |
-0.2 |
0.653 |
2 |
0 |
0 |
0.002 |
9 |
|
[ACT]A:567 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
22395 |
88.8 |
-0.2 |
0.670 |
2 |
0 |
0 |
0.002 |
Average: |
88.8 |
-0.2 |
0.661 |
2 |
0 |
0 |
0.002 |
8 |
10 |
|
A |
8 |
3 |
22395 |
x |
A |
x,y,z-1 |
1_554 |
12 |
4 |
22395 |
82.4 |
-0.5 |
0.468 |
0 |
0 |
0 |
0.000 |
9 |
11 |
|
[ACT]A:568 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
13 |
5 |
22395 |
82.0 |
-0.4 |
0.616 |
0 |
0 |
0 |
0.000 |
10 |
12 |
|
A |
8 |
3 |
22395 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
12 |
4 |
22351 |
81.8 |
0.4 |
0.559 |
1 |
2 |
0 |
0.000 |
11 |
13 |
|
A |
13 |
5 |
22395 |
◊ |
[ACT]B:567 |
-x,y-1/2,-z |
2_545 |
4 |
1 |
182 |
75.9 |
1.1 |
0.821 |
2 |
0 |
0 |
0.000 |
12 |
14 |
|
B |
8 |
3 |
22351 |
x |
B |
x,y,z-1 |
1_554 |
9 |
4 |
22351 |
73.2 |
0.9 |
0.749 |
1 |
1 |
0 |
0.000 |
13 |
15 |
|
[ACT]B:569 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
13 |
4 |
22351 |
70.4 |
1.1 |
0.801 |
2 |
0 |
0 |
0.000 |
14 |
16 |
|
[ACT]B:567 |
3 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
22351 |
59.4 |
-1.4 |
0.374 |
0 |
0 |
0 |
0.003 |
15 |
17 |
|
A |
7 |
5 |
22395 |
f |
[ACT]B:569 |
-x,y-1/2,-z |
2_545 |
3 |
1 |
183 |
56.0 |
-1.3 |
0.369 |
0 |
0 |
0 |
0.002 |
16 |
18 |
|
B |
12 |
4 |
22351 |
x |
B |
x-1,y,z |
1_455 |
7 |
3 |
22351 |
48.8 |
-0.4 |
0.464 |
0 |
0 |
0 |
0.000 |
17 |
19 |
|
A |
5 |
2 |
22395 |
x |
A |
x-1,y,z-1 |
1_454 |
2 |
1 |
22395 |
39.2 |
0.3 |
0.699 |
1 |
0 |
0 |
0.000 |
18 |
20 |
|
[ZN]B:565 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
6 |
22351 |
36.0 |
-24.9 |
0.000 |
0 |
0 |
0 |
0.050 |
21 |
|
[ZN]A:566 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
6 |
22395 |
35.6 |
-26.2 |
0.000 |
0 |
0 |
0 |
0.050 |
Average: |
35.8 |
-25.5 |
0.000 |
0 |
0 |
0 |
0.050 |
19 |
22 |
|
[ZN]B:565 |
1 |
1 |
98 |
f |
[3A1]B:566 |
x,y,z |
1_555 |
7 |
1 |
930 |
32.4 |
-15.2 |
0.000 |
0 |
0 |
0 |
0.031 |
23 |
|
[ZN]A:566 |
1 |
1 |
98 |
f |
[3A1]A:565 |
x,y,z |
1_555 |
8 |
1 |
911 |
32.4 |
-15.3 |
0.000 |
0 |
0 |
0 |
0.031 |
Average: |
32.4 |
-15.2 |
0.000 |
0 |
0 |
0 |
0.031 |
20 |
24 |
|
[ACT]A:568 |
4 |
1 |
183 |
◊ |
[ACT]B:569 |
-x,y-1/2,-z |
2_545 |
3 |
1 |
183 |
29.2 |
-0.0 |
0.747 |
0 |
0 |
0 |
0.000 |
21 |
25 |
|
[ACT]A:568 |
2 |
1 |
183 |
f |
B |
-x,y-1/2,-z |
2_545 |
4 |
4 |
22351 |
19.0 |
0.6 |
0.796 |
0 |
0 |
0 |
0.000 |
|