## |
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 |
112 |
31 |
12246 |
◊ |
A |
x,y,z |
1_555 |
108 |
32 |
12592 |
1035.8 |
-10.3 |
0.212 |
11 |
4 |
0 |
0.170 |
2 |
|
B |
99 |
30 |
12271 |
◊ |
B |
-x+1,-y+1,z |
2_665 |
99 |
30 |
12271 |
947.4 |
-9.6 |
0.206 |
10 |
6 |
0 |
0.170 |
Average: |
991.6 |
-10.0 |
0.209 |
11 |
5 |
0 |
0.170 |
2 |
3 |
|
C |
32 |
11 |
12246 |
◊ |
B |
x-1/2,-y+1/2,-z+2 |
4_457 |
26 |
7 |
12271 |
294.2 |
-6.7 |
0.056 |
3 |
4 |
0 |
0.036 |
3 |
4 |
|
C |
30 |
10 |
12246 |
◊ |
A |
x-1/2,-y+1/2,-z+2 |
4_457 |
29 |
10 |
12592 |
280.0 |
2.2 |
0.748 |
6 |
5 |
0 |
0.005 |
4 |
5 |
|
B |
24 |
9 |
12271 |
◊ |
A |
x,y,z |
1_555 |
30 |
11 |
12592 |
253.9 |
0.3 |
0.669 |
4 |
6 |
0 |
0.010 |
5 |
6 |
|
[AM1]B:1201 |
15 |
1 |
361 |
f |
B |
x,y,z |
1_555 |
40 |
15 |
12271 |
238.8 |
2.3 |
0.478 |
12 |
0 |
0 |
0.065 |
7 |
|
[AM1]C:1202 |
15 |
1 |
363 |
f |
C |
x,y,z |
1_555 |
40 |
15 |
12246 |
238.5 |
2.3 |
0.496 |
12 |
0 |
0 |
0.065 |
8 |
|
[AM1]A:1200 |
15 |
1 |
363 |
f |
A |
x,y,z |
1_555 |
40 |
15 |
12592 |
238.1 |
2.3 |
0.465 |
12 |
0 |
0 |
0.065 |
Average: |
238.5 |
2.3 |
0.480 |
12 |
0 |
0 |
0.065 |
6 |
9 |
|
B |
24 |
10 |
12271 |
x |
B |
x,y,z-1 |
1_554 |
20 |
7 |
12271 |
170.8 |
-1.7 |
0.409 |
0 |
0 |
0 |
0.000 |
10 |
|
A |
22 |
9 |
12592 |
x |
A |
x,y,z-1 |
1_554 |
17 |
7 |
12592 |
161.9 |
-0.3 |
0.576 |
0 |
0 |
0 |
0.000 |
11 |
|
C |
23 |
11 |
12246 |
x |
C |
x,y,z-1 |
1_554 |
19 |
8 |
12246 |
141.8 |
-1.3 |
0.496 |
0 |
0 |
0 |
0.000 |
Average: |
158.2 |
-1.1 |
0.493 |
0 |
0 |
0 |
0.000 |
7 |
12 |
|
C |
9 |
3 |
12246 |
◊ |
A |
-x+1,-y,z |
2_655 |
12 |
3 |
12592 |
122.5 |
-1.8 |
0.103 |
1 |
0 |
0 |
0.000 |
8 |
13 |
|
A |
11 |
4 |
12592 |
◊ |
B |
-x+3/2,y-1/2,-z+2 |
3_647 |
13 |
5 |
12271 |
107.5 |
1.4 |
0.802 |
4 |
3 |
0 |
0.008 |
9 |
14 |
|
[ACT]B:1203 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
14 |
7 |
12271 |
83.4 |
-0.2 |
0.658 |
1 |
0 |
0 |
0.008 |
10 |
15 |
|
C |
7 |
2 |
12246 |
◊ |
B |
x,y,z |
1_555 |
10 |
4 |
12271 |
78.8 |
-1.4 |
0.232 |
0 |
0 |
0 |
0.000 |
11 |
16 |
|
[ZN]C:1208 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
10 |
6 |
12246 |
50.1 |
-31.7 |
0.000 |
0 |
0 |
0 |
0.541 |
17 |
|
[ZN]B:1207 |
1 |
1 |
98 |
cf |
B |
x,y,z |
1_555 |
10 |
5 |
12271 |
41.3 |
-26.5 |
0.000 |
0 |
0 |
0 |
0.541 |
18 |
|
[ZN]B:1205 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
12592 |
34.9 |
-18.5 |
0.000 |
0 |
0 |
0 |
0.541 |
Average: |
42.1 |
-25.5 |
0.000 |
0 |
0 |
0 |
0.541 |
12 |
19 |
|
C |
6 |
3 |
12246 |
f |
[ZN]A:1204 |
x-1/2,-y+1/2,-z+2 |
4_457 |
1 |
1 |
98 |
42.6 |
-20.8 |
0.000 |
0 |
0 |
0 |
0.224 |
13 |
20 |
|
[ZN]B:1209 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
12271 |
40.0 |
-15.8 |
0.000 |
0 |
0 |
0 |
0.198 |
14 |
21 |
|
[ZN]A:1204 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
12592 |
37.5 |
-18.0 |
0.000 |
0 |
0 |
0 |
0.156 |
22 |
|
C |
5 |
3 |
12246 |
◊ |
[ZN]B:1206 |
x-1/2,-y+1/2,-z+2 |
4_457 |
1 |
1 |
98 |
36.2 |
-18.7 |
0.000 |
0 |
0 |
0 |
0.156 |
Average: |
36.8 |
-18.3 |
0.000 |
0 |
0 |
0 |
0.156 |
15 |
23 |
|
[ZN]B:1206 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
12271 |
36.4 |
-20.4 |
0.000 |
0 |
0 |
0 |
0.256 |
16 |
24 |
|
[ZN]B:1205 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
12271 |
33.6 |
-15.1 |
0.000 |
0 |
0 |
0 |
0.064 |
17 |
25 |
|
[ZN]B:1209 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
12592 |
30.6 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.049 |
18 |
26 |
|
A |
3 |
1 |
12592 |
◊ |
[ZN]B:1207 |
-x+3/2,y-1/2,-z+2 |
3_647 |
1 |
1 |
98 |
30.0 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.114 |
19 |
27 |
|
[ACT]B:1203 |
3 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
12592 |
26.6 |
0.8 |
0.788 |
2 |
0 |
0 |
0.000 |
20 |
28 |
|
[ACT]B:1203 |
1 |
1 |
183 |
f |
[ZN]B:1209 |
x,y,z |
1_555 |
1 |
1 |
98 |
18.3 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.073 |
21 |
29 |
|
C |
2 |
1 |
12246 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
2 |
1 |
12592 |
15.9 |
0.3 |
0.500 |
0 |
0 |
0 |
0.000 |
22 |
30 |
|
[ZN]B:1209 |
1 |
1 |
98 |
◊ |
[ZN]B:1205 |
x,y,z |
1_555 |
1 |
1 |
98 |
13.7 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.046 |
23 |
31 |
|
B |
1 |
1 |
12271 |
◊ |
A |
x-1/2,-y+1/2,-z+2 |
4_457 |
1 |
1 |
12592 |
1.3 |
0.0 |
0.629 |
0 |
0 |
0 |
0.000 |
|