## |
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 |
57 |
18 |
9608 |
◊ |
A |
x,y,z |
1_555 |
56 |
18 |
9566 |
529.8 |
-2.5 |
0.440 |
0 |
0 |
0 |
0.000 |
2 |
2 |
|
B |
39 |
10 |
9608 |
◊ |
A |
-x,y,-z+2 |
2_557 |
38 |
10 |
9566 |
372.2 |
1.5 |
0.774 |
8 |
2 |
0 |
0.000 |
3 |
3 |
|
[OK3]B:600 |
26 |
1 |
559 |
f |
B |
x,y,z |
1_555 |
60 |
17 |
9608 |
366.6 |
-7.0 |
0.246 |
10 |
0 |
0 |
0.010 |
4 |
|
[OK3]A:600 |
26 |
1 |
556 |
f |
A |
x,y,z |
1_555 |
52 |
16 |
9566 |
356.5 |
-7.7 |
0.181 |
7 |
0 |
0 |
0.010 |
Average: |
361.6 |
-7.3 |
0.213 |
9 |
0 |
0 |
0.010 |
4 |
5 |
|
A |
25 |
7 |
9566 |
x |
A |
-x+1/2,y-1/2,-z+2 |
4_547 |
31 |
12 |
9566 |
240.2 |
-1.5 |
0.468 |
2 |
2 |
0 |
0.000 |
6 |
|
B |
28 |
10 |
9608 |
x |
B |
-x+1/2,y-1/2,-z+3 |
4_548 |
22 |
6 |
9608 |
214.6 |
-2.0 |
0.306 |
0 |
0 |
0 |
0.000 |
Average: |
227.4 |
-1.7 |
0.387 |
1 |
1 |
0 |
0.000 |
5 |
7 |
|
B |
19 |
7 |
9608 |
◊ |
A |
x-1/2,y-1/2,z |
3_445 |
24 |
6 |
9566 |
169.9 |
0.7 |
0.627 |
2 |
0 |
0 |
0.000 |
8 |
|
A |
12 |
4 |
9566 |
◊ |
B |
x-1/2,y+1/2,z-1 |
3_454 |
16 |
5 |
9608 |
122.3 |
1.0 |
0.742 |
2 |
0 |
0 |
0.000 |
Average: |
146.1 |
0.8 |
0.684 |
2 |
0 |
0 |
0.000 |
6 |
9 |
|
A |
15 |
6 |
9566 |
◊ |
B |
x,y,z-1 |
1_554 |
13 |
4 |
9608 |
125.3 |
-1.8 |
0.268 |
0 |
0 |
0 |
0.000 |
7 |
10 |
|
[DMS]A:700 |
4 |
1 |
208 |
f |
A |
x,y,z |
1_555 |
22 |
9 |
9566 |
124.7 |
3.6 |
0.583 |
0 |
0 |
0 |
0.000 |
8 |
11 |
|
B |
17 |
7 |
9608 |
◊ |
A |
-x+1,y,-z+3 |
2_658 |
14 |
4 |
9566 |
83.5 |
0.8 |
0.734 |
0 |
2 |
0 |
0.000 |
9 |
12 |
|
B |
6 |
2 |
9608 |
◊ |
A |
-x+1/2,y-1/2,-z+3 |
4_548 |
10 |
4 |
9566 |
72.8 |
2.3 |
0.892 |
2 |
0 |
0 |
0.000 |
13 |
|
B |
8 |
4 |
9608 |
◊ |
A |
-x+1/2,y-1/2,-z+2 |
4_547 |
9 |
2 |
9566 |
61.4 |
0.0 |
0.602 |
0 |
0 |
0 |
0.000 |
Average: |
67.1 |
1.2 |
0.747 |
1 |
0 |
0 |
0.000 |
10 |
14 |
|
A |
9 |
4 |
9566 |
◊ |
[FMT]A:401 |
-x+1/2,y-1/2,-z+2 |
4_547 |
3 |
1 |
151 |
53.5 |
-0.0 |
0.673 |
2 |
0 |
0 |
0.000 |
11 |
15 |
|
[FMT]B:400 |
3 |
1 |
148 |
◊ |
B |
-x+1/2,y-1/2,-z+3 |
4_548 |
9 |
4 |
9608 |
52.8 |
0.1 |
0.670 |
2 |
0 |
0 |
0.000 |
12 |
16 |
|
[FMT]B:401 |
3 |
1 |
148 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
9608 |
52.0 |
-0.7 |
0.220 |
1 |
0 |
0 |
0.000 |
13 |
17 |
|
[FMT]A:400 |
3 |
1 |
148 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
9566 |
51.7 |
-0.3 |
0.350 |
1 |
0 |
0 |
0.000 |
14 |
18 |
|
[FMT]B:401 |
3 |
1 |
148 |
◊ |
B |
-x+1/2,y-1/2,-z+3 |
4_548 |
10 |
5 |
9608 |
45.4 |
-0.2 |
0.392 |
1 |
0 |
0 |
0.000 |
15 |
19 |
|
A |
11 |
5 |
9566 |
◊ |
[FMT]A:400 |
-x+1/2,y-1/2,-z+2 |
4_547 |
3 |
1 |
148 |
42.3 |
-0.1 |
0.414 |
1 |
0 |
0 |
0.000 |
16 |
20 |
|
A |
3 |
2 |
9566 |
◊ |
A |
-x+1,y,-z+3 |
2_658 |
3 |
2 |
9566 |
38.9 |
-0.3 |
0.418 |
0 |
0 |
0 |
0.000 |
17 |
21 |
|
[FMT]A:401 |
3 |
1 |
151 |
f |
A |
x,y,z |
1_555 |
5 |
3 |
9566 |
36.7 |
0.0 |
0.526 |
2 |
0 |
0 |
0.000 |
18 |
22 |
|
[FMT]B:400 |
3 |
1 |
148 |
f |
B |
x,y,z |
1_555 |
6 |
3 |
9608 |
35.0 |
-0.5 |
0.228 |
1 |
0 |
0 |
0.000 |
19 |
23 |
|
[ZN]A:501 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
9566 |
33.6 |
-21.8 |
0.000 |
0 |
0 |
0 |
0.019 |
24 |
|
[ZN]B:501 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
9608 |
33.4 |
-21.4 |
0.000 |
0 |
0 |
0 |
0.019 |
Average: |
33.5 |
-21.6 |
0.000 |
0 |
0 |
0 |
0.019 |
20 |
25 |
|
[ZN]B:500 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
9608 |
33.2 |
-24.2 |
0.000 |
0 |
0 |
0 |
0.021 |
26 |
|
[ZN]A:500 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
9566 |
33.0 |
-24.7 |
0.000 |
0 |
0 |
0 |
0.021 |
Average: |
33.1 |
-24.5 |
0.000 |
0 |
0 |
0 |
0.021 |
21 |
27 |
|
[OK3]A:600 |
7 |
1 |
556 |
f |
[ZN]A:501 |
x,y,z |
1_555 |
1 |
1 |
98 |
32.0 |
-15.5 |
0.000 |
0 |
0 |
0 |
0.013 |
28 |
|
[OK3]B:600 |
7 |
1 |
559 |
f |
[ZN]B:501 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.5 |
-15.4 |
0.000 |
0 |
0 |
0 |
0.013 |
Average: |
31.8 |
-15.5 |
0.000 |
0 |
0 |
0 |
0.013 |
22 |
29 |
|
[OK3]B:600 |
4 |
1 |
559 |
f |
[ZN]B:500 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.0 |
-13.1 |
0.000 |
0 |
0 |
0 |
0.011 |
30 |
|
[OK3]A:600 |
6 |
1 |
556 |
f |
[ZN]A:500 |
x,y,z |
1_555 |
1 |
1 |
98 |
29.8 |
-13.0 |
0.000 |
0 |
0 |
0 |
0.011 |
Average: |
29.9 |
-13.0 |
0.000 |
0 |
0 |
0 |
0.011 |
23 |
31 |
|
[ZN]A:502 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
9566 |
24.0 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.010 |
32 |
|
[ZN]B:502 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
3 |
9608 |
23.0 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.010 |
Average: |
23.5 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.010 |
24 |
33 |
|
[ZN]B:502 |
1 |
1 |
98 |
◊ |
B |
-x+1/2,y-1/2,-z+3 |
4_548 |
7 |
3 |
9608 |
23.8 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.000 |
34 |
|
A |
8 |
4 |
9566 |
◊ |
[ZN]A:502 |
-x+1/2,y-1/2,-z+2 |
4_547 |
1 |
1 |
98 |
23.2 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
23.5 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.000 |
25 |
35 |
|
[ZN]A:502 |
1 |
1 |
98 |
cf |
[FMT]A:401 |
x,y,z |
1_555 |
3 |
1 |
151 |
21.7 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.013 |
36 |
|
[ZN]B:502 |
1 |
1 |
98 |
cf |
[FMT]B:400 |
x,y,z |
1_555 |
3 |
1 |
148 |
21.2 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.013 |
37 |
|
[ZN]B:502 |
1 |
1 |
98 |
f |
[FMT]B:401 |
x,y,z |
1_555 |
3 |
1 |
148 |
18.5 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.013 |
38 |
|
[ZN]A:502 |
1 |
1 |
98 |
f |
[FMT]A:400 |
x,y,z |
1_555 |
3 |
1 |
148 |
17.9 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.013 |
Average: |
19.8 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.013 |
26 |
39 |
|
[FMT]A:401 |
1 |
1 |
151 |
f |
[FMT]A:400 |
x,y,z |
1_555 |
3 |
1 |
148 |
18.8 |
0.4 |
0.484 |
0 |
0 |
0 |
0.000 |
27 |
40 |
|
[FMT]B:401 |
3 |
1 |
148 |
f |
[FMT]B:400 |
x,y,z |
1_555 |
2 |
1 |
148 |
17.4 |
0.3 |
0.380 |
0 |
0 |
0 |
0.000 |
28 |
41 |
|
A |
1 |
1 |
9566 |
◊ |
A |
-x,y,-z+2 |
2_557 |
1 |
1 |
9566 |
15.3 |
0.3 |
0.859 |
0 |
0 |
0 |
0.000 |
29 |
42 |
|
B |
3 |
2 |
9608 |
◊ |
B |
-x+1,y,-z+3 |
2_658 |
3 |
2 |
9608 |
14.2 |
-0.2 |
0.491 |
0 |
0 |
0 |
0.000 |
30 |
43 |
|
[ZN]A:501 |
1 |
1 |
98 |
f |
[ZN]A:500 |
x,y,z |
1_555 |
1 |
1 |
98 |
6.9 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.005 |
31 |
44 |
|
[ZN]B:501 |
1 |
1 |
98 |
f |
[ZN]B:500 |
x,y,z |
1_555 |
1 |
1 |
98 |
6.7 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.004 |
32 |
45 |
|
B |
1 |
1 |
9608 |
◊ |
B |
-x,y,-z+2 |
2_557 |
1 |
1 |
9608 |
2.3 |
0.1 |
0.723 |
0 |
0 |
0 |
0.000 |
|