## |
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 |
|
D |
76 |
26 |
5424 |
◊ |
C |
x,y,z |
1_555 |
78 |
23 |
5669 |
869.5 |
-8.6 |
0.316 |
14 |
3 |
0 |
0.155 |
2 |
|
B |
74 |
23 |
5156 |
◊ |
A |
x,y,z |
1_555 |
81 |
25 |
5785 |
857.5 |
-8.4 |
0.330 |
14 |
3 |
0 |
0.155 |
Average: |
863.5 |
-8.5 |
0.323 |
14 |
3 |
0 |
0.155 |
2 |
3 |
|
B |
32 |
10 |
5156 |
◊ |
D |
-x+2,y-1/2,-z+2 |
2_747 |
34 |
9 |
5424 |
275.9 |
-3.0 |
0.444 |
2 |
0 |
0 |
0.000 |
3 |
4 |
|
D |
30 |
11 |
5424 |
◊ |
A |
x,y,z-1 |
1_554 |
31 |
10 |
5785 |
274.9 |
-3.9 |
0.329 |
1 |
0 |
0 |
0.000 |
4 |
5 |
|
C |
31 |
9 |
5669 |
◊ |
A |
-x+2,y-1/2,-z+2 |
2_747 |
34 |
12 |
5785 |
256.2 |
-2.0 |
0.558 |
1 |
0 |
0 |
0.000 |
5 |
6 |
|
C |
30 |
10 |
5669 |
◊ |
B |
x,y,z-1 |
1_554 |
26 |
10 |
5156 |
246.1 |
-1.9 |
0.533 |
4 |
1 |
0 |
0.000 |
6 |
7 |
|
C |
21 |
6 |
5669 |
◊ |
A |
-x+3,y-1/2,-z+2 |
2_847 |
17 |
6 |
5785 |
199.0 |
-2.6 |
0.372 |
3 |
0 |
0 |
0.000 |
7 |
8 |
|
A |
20 |
7 |
5785 |
◊ |
D |
x-1,y,z |
1_455 |
25 |
8 |
5424 |
198.2 |
-2.0 |
0.468 |
1 |
0 |
0 |
0.012 |
8 |
9 |
|
B |
25 |
7 |
5156 |
◊ |
A |
-x+2,y-1/2,-z+2 |
2_747 |
17 |
5 |
5785 |
177.6 |
-2.8 |
0.215 |
2 |
0 |
0 |
0.000 |
9 |
10 |
|
B |
20 |
5 |
5156 |
◊ |
C |
x-1,y,z |
1_455 |
19 |
7 |
5669 |
170.2 |
-1.8 |
0.475 |
2 |
0 |
0 |
0.013 |
10 |
11 |
|
C |
13 |
4 |
5669 |
◊ |
D |
-x+3,y-1/2,-z+1 |
2_846 |
22 |
8 |
5424 |
147.5 |
-2.9 |
0.278 |
0 |
0 |
0 |
0.000 |
11 |
12 |
|
D |
16 |
5 |
5424 |
x |
D |
x-1,y,z |
1_455 |
16 |
6 |
5424 |
143.1 |
-0.2 |
0.666 |
3 |
4 |
0 |
0.000 |
12 |
13 |
|
[1PE]C:102 |
14 |
1 |
428 |
◊ |
C |
x,y,z |
1_555 |
16 |
4 |
5669 |
131.4 |
-0.3 |
0.696 |
0 |
0 |
0 |
0.002 |
13 |
14 |
|
[ACT]C:101 |
4 |
1 |
183 |
f |
C |
x,y,z |
1_555 |
22 |
12 |
5669 |
122.4 |
-1.1 |
0.612 |
2 |
0 |
0 |
0.020 |
14 |
15 |
|
A |
16 |
3 |
5785 |
x |
A |
x-1,y,z |
1_455 |
12 |
4 |
5785 |
122.0 |
-0.5 |
0.608 |
1 |
0 |
0 |
0.000 |
15 |
16 |
|
[ACT]A:101 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
21 |
11 |
5785 |
117.3 |
-1.1 |
0.594 |
2 |
0 |
0 |
0.020 |
16 |
17 |
|
[ACT]B:101 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
19 |
11 |
5156 |
112.5 |
-0.9 |
0.609 |
4 |
0 |
0 |
0.027 |
18 |
|
[ACT]D:101 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
15 |
11 |
5424 |
104.5 |
-0.8 |
0.604 |
3 |
0 |
0 |
0.027 |
Average: |
108.5 |
-0.9 |
0.606 |
4 |
0 |
0 |
0.027 |
17 |
19 |
|
B |
17 |
5 |
5156 |
f |
[1PE]C:102 |
x-1,y,z |
1_455 |
9 |
1 |
428 |
99.4 |
-0.6 |
0.633 |
0 |
0 |
0 |
0.006 |
18 |
20 |
|
D |
11 |
3 |
5424 |
◊ |
A |
x,y,z |
1_555 |
11 |
4 |
5785 |
90.7 |
-0.3 |
0.545 |
1 |
0 |
0 |
0.000 |
19 |
21 |
|
A |
11 |
3 |
5785 |
◊ |
D |
x-1,y,z+1 |
1_456 |
11 |
5 |
5424 |
87.7 |
0.4 |
0.678 |
1 |
0 |
0 |
0.000 |
20 |
22 |
|
C |
12 |
5 |
5669 |
◊ |
B |
x,y,z |
1_555 |
10 |
4 |
5156 |
81.6 |
-0.3 |
0.598 |
0 |
0 |
0 |
0.000 |
21 |
23 |
|
[ZN]B:100 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
5156 |
49.3 |
-35.3 |
0.000 |
0 |
0 |
0 |
0.689 |
24 |
|
[ZN]C:100 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
8 |
6 |
5669 |
48.4 |
-34.6 |
0.000 |
0 |
0 |
0 |
0.689 |
25 |
|
[ZN]A:100 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
8 |
5785 |
48.4 |
-33.3 |
0.000 |
0 |
0 |
0 |
0.689 |
26 |
|
[ZN]D:100 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
9 |
6 |
5424 |
47.2 |
-32.2 |
0.000 |
0 |
0 |
0 |
0.689 |
Average: |
48.3 |
-33.8 |
0.000 |
0 |
0 |
0 |
0.689 |
22 |
27 |
|
B |
5 |
2 |
5156 |
◊ |
D |
x-1,y,z |
1_455 |
2 |
1 |
5424 |
38.5 |
-0.8 |
0.206 |
0 |
0 |
0 |
0.004 |
23 |
28 |
|
B |
3 |
2 |
5156 |
◊ |
C |
x-1,y,z+1 |
1_456 |
6 |
3 |
5669 |
37.5 |
-0.1 |
0.431 |
0 |
0 |
0 |
0.000 |
24 |
29 |
|
C |
2 |
1 |
5669 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
5785 |
33.1 |
0.1 |
0.349 |
0 |
0 |
0 |
0.000 |
25 |
30 |
|
[ACT]D:101 |
2 |
1 |
184 |
f |
[ZN]D:100 |
x,y,z |
1_555 |
1 |
1 |
98 |
16.5 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.125 |
31 |
|
[ACT]C:101 |
2 |
1 |
183 |
f |
[ZN]C:100 |
x,y,z |
1_555 |
1 |
1 |
98 |
14.1 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.125 |
32 |
|
[ACT]A:101 |
2 |
1 |
182 |
f |
[ZN]A:100 |
x,y,z |
1_555 |
1 |
1 |
98 |
14.0 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.125 |
33 |
|
[ACT]B:101 |
2 |
1 |
182 |
f |
[ZN]B:100 |
x,y,z |
1_555 |
1 |
1 |
98 |
12.4 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.125 |
Average: |
14.2 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.125 |
26 |
34 |
|
D |
1 |
1 |
5424 |
◊ |
B |
x,y,z-1 |
1_554 |
1 |
1 |
5156 |
7.3 |
-0.2 |
0.318 |
0 |
0 |
0 |
0.000 |
27 |
35 |
|
C |
3 |
3 |
5669 |
◊ |
A |
x,y,z-1 |
1_554 |
2 |
2 |
5785 |
3.9 |
-0.1 |
0.589 |
0 |
0 |
0 |
0.000 |
28 |
36 |
|
B |
1 |
1 |
5156 |
◊ |
D |
-x+3,y-1/2,-z+2 |
2_847 |
1 |
1 |
5424 |
3.9 |
-0.0 |
0.561 |
0 |
0 |
0 |
0.000 |
29 |
37 |
|
[1PE]C:102 |
1 |
1 |
428 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
5785 |
2.3 |
0.0 |
0.662 |
0 |
0 |
0 |
0.000 |
30 |
38 |
|
[ACT]B:101 |
1 |
1 |
182 |
f |
[1PE]C:102 |
x-1,y,z |
1_455 |
1 |
1 |
428 |
2.1 |
-0.0 |
0.530 |
0 |
0 |
0 |
0.000 |
|