## |
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 |
|
C |
129 |
37 |
7199 |
◊ |
B |
x,y,z |
1_555 |
113 |
31 |
7567 |
1075.1 |
-4.7 |
0.582 |
21 |
7 |
0 |
0.151 |
2 |
|
B |
124 |
36 |
7567 |
◊ |
A |
x,y,z |
1_555 |
113 |
32 |
7477 |
1046.4 |
-5.9 |
0.521 |
17 |
4 |
0 |
0.151 |
3 |
|
C |
108 |
30 |
7199 |
◊ |
A |
x,y,z |
1_555 |
122 |
35 |
7477 |
1015.6 |
-5.5 |
0.492 |
17 |
4 |
0 |
0.151 |
Average: |
1045.7 |
-5.4 |
0.532 |
18 |
5 |
0 |
0.151 |
2 |
4 |
|
B |
46 |
15 |
7567 |
◊ |
A |
-x,y,-z-1 |
2_554 |
41 |
11 |
7477 |
403.5 |
-0.2 |
0.583 |
6 |
7 |
0 |
0.000 |
3 |
5 |
|
C |
46 |
15 |
7199 |
◊ |
A |
-x+1/2,y-1/2,-z |
4_545 |
40 |
12 |
7477 |
375.6 |
-0.5 |
0.630 |
5 |
1 |
0 |
0.000 |
4 |
6 |
|
B |
46 |
14 |
7567 |
x |
B |
-x+1/2,y-1/2,-z-1 |
4_544 |
37 |
12 |
7567 |
343.8 |
-2.4 |
0.542 |
3 |
0 |
0 |
0.000 |
5 |
7 |
|
A |
33 |
13 |
7477 |
◊ |
A |
-x,y,-z |
2_555 |
33 |
13 |
7477 |
278.1 |
1.4 |
0.794 |
2 |
0 |
0 |
0.000 |
6 |
8 |
|
C |
28 |
9 |
7199 |
x |
C |
-x+1/2,y-1/2,-z |
4_545 |
29 |
10 |
7199 |
232.5 |
-0.4 |
0.602 |
3 |
0 |
0 |
0.000 |
7 |
9 |
|
[I5A]C:164 |
16 |
1 |
413 |
◊ |
C |
x,y,z |
1_555 |
32 |
12 |
7199 |
215.6 |
2.1 |
0.540 |
6 |
0 |
0 |
0.005 |
10 |
|
[I5A]A:164 |
13 |
1 |
412 |
◊ |
A |
x,y,z |
1_555 |
30 |
11 |
7477 |
203.4 |
1.3 |
0.499 |
5 |
0 |
0 |
0.005 |
11 |
|
[I5A]B:164 |
14 |
1 |
404 |
◊ |
B |
x,y,z |
1_555 |
28 |
11 |
7567 |
199.7 |
2.3 |
0.570 |
5 |
0 |
0 |
0.005 |
Average: |
206.3 |
1.9 |
0.536 |
5 |
0 |
0 |
0.005 |
8 |
12 |
|
C |
12 |
5 |
7199 |
◊ |
B |
-x+1/2,y-1/2,-z-1 |
4_544 |
16 |
5 |
7567 |
104.9 |
0.2 |
0.700 |
2 |
0 |
0 |
0.000 |
9 |
13 |
|
[I5A]B:164 |
7 |
1 |
404 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
7477 |
80.6 |
-1.5 |
0.228 |
0 |
0 |
0 |
0.005 |
10 |
14 |
|
[I5A]C:164 |
7 |
1 |
413 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
7567 |
70.4 |
-1.5 |
0.260 |
1 |
0 |
0 |
0.012 |
15 |
|
[I5A]A:164 |
7 |
1 |
412 |
f |
C |
x,y,z |
1_555 |
10 |
4 |
7199 |
64.1 |
-1.0 |
0.299 |
1 |
0 |
0 |
0.012 |
Average: |
67.2 |
-1.3 |
0.279 |
1 |
0 |
0 |
0.012 |
11 |
16 |
|
[CL]A:165 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
7477 |
70.0 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.043 |
12 |
17 |
|
[K]A:166 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
11 |
5 |
7477 |
67.2 |
-38.5 |
0.000 |
0 |
0 |
0 |
0.380 |
18 |
|
[K]A:166 |
1 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
11 |
6 |
7199 |
62.8 |
-35.0 |
0.000 |
0 |
0 |
0 |
0.380 |
19 |
|
[K]A:166 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
10 |
6 |
7567 |
62.3 |
-34.5 |
0.000 |
0 |
0 |
0 |
0.380 |
Average: |
64.1 |
-36.0 |
0.000 |
0 |
0 |
0 |
0.380 |
13 |
20 |
|
[ZN]A:163 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
7477 |
47.4 |
-34.3 |
0.000 |
0 |
0 |
0 |
0.358 |
21 |
|
[ZN]B:163 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
7567 |
47.3 |
-33.6 |
0.000 |
0 |
0 |
0 |
0.358 |
22 |
|
[ZN]C:163 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
7 |
3 |
7199 |
47.2 |
-33.7 |
0.000 |
0 |
0 |
0 |
0.358 |
Average: |
47.3 |
-33.9 |
0.000 |
0 |
0 |
0 |
0.358 |
14 |
23 |
|
A |
5 |
1 |
7477 |
◊ |
A |
-x,y,-z-1 |
2_554 |
4 |
1 |
7477 |
31.0 |
0.8 |
0.832 |
0 |
0 |
0 |
0.000 |
15 |
24 |
|
B |
4 |
2 |
7567 |
◊ |
C |
-x+1/2,y-1/2,-z-1 |
4_544 |
5 |
2 |
7199 |
30.1 |
-0.2 |
0.543 |
0 |
0 |
0 |
0.000 |
16 |
25 |
|
[ZN]B:163 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
7199 |
12.2 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.045 |
26 |
|
[ZN]A:163 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
7567 |
11.7 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.045 |
27 |
|
[ZN]C:163 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
7477 |
11.5 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.045 |
Average: |
11.8 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.045 |
17 |
28 |
|
B |
1 |
1 |
7567 |
◊ |
B |
-x,y,-z-1 |
2_554 |
1 |
1 |
7567 |
8.8 |
0.3 |
0.851 |
0 |
0 |
0 |
0.000 |
|