## |
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 |
|
E |
143 |
34 |
12520 |
◊ |
A |
x,y,z |
1_555 |
175 |
48 |
17625 |
1541.2 |
-18.1 |
0.157 |
19 |
5 |
0 |
0.488 |
2 |
2 |
|
D |
146 |
40 |
17309 |
◊ |
C |
x,y,z |
1_555 |
144 |
37 |
17901 |
1362.0 |
-12.3 |
0.173 |
19 |
12 |
0 |
0.327 |
3 |
|
B |
140 |
38 |
17809 |
◊ |
A |
x,y,z |
1_555 |
143 |
35 |
17625 |
1324.9 |
-14.9 |
0.071 |
12 |
9 |
0 |
0.327 |
Average: |
1343.4 |
-13.6 |
0.122 |
16 |
11 |
0 |
0.327 |
3 |
4 |
|
B |
91 |
25 |
17809 |
◊ |
C |
x,y,z |
1_555 |
108 |
29 |
17901 |
882.9 |
-10.1 |
0.129 |
13 |
1 |
0 |
0.232 |
4 |
5 |
|
D |
89 |
24 |
17309 |
◊ |
F |
-x,y-1/2,-z+1/2 |
3_545 |
95 |
26 |
17322 |
815.1 |
4.1 |
0.786 |
14 |
3 |
0 |
0.000 |
5 |
6 |
|
E |
75 |
16 |
12520 |
◊ |
C |
x,y,z |
1_555 |
83 |
25 |
17901 |
778.0 |
-10.4 |
0.168 |
6 |
3 |
0 |
0.338 |
6 |
7 |
|
F |
80 |
22 |
17322 |
◊ |
A |
x,y,z |
1_555 |
87 |
23 |
17625 |
776.8 |
-0.6 |
0.671 |
8 |
7 |
0 |
0.000 |
7 |
8 |
|
E |
64 |
17 |
12520 |
◊ |
D |
x,y,z |
1_555 |
86 |
25 |
17309 |
696.8 |
-4.0 |
0.522 |
5 |
4 |
0 |
0.077 |
8 |
9 |
|
E |
60 |
15 |
12520 |
◊ |
B |
x,y,z |
1_555 |
78 |
21 |
17809 |
657.0 |
-2.5 |
0.567 |
6 |
5 |
0 |
0.059 |
9 |
10 |
|
C |
61 |
17 |
17901 |
◊ |
E |
x-1/2,-y+1/2,-z |
4_455 |
46 |
12 |
12520 |
500.7 |
-1.2 |
0.642 |
5 |
5 |
0 |
0.000 |
10 |
11 |
|
F |
52 |
13 |
17322 |
◊ |
B |
x,y,z |
1_555 |
50 |
13 |
17809 |
472.1 |
1.2 |
0.731 |
4 |
1 |
0 |
0.000 |
11 |
12 |
|
[ACP]F:401 |
31 |
1 |
612 |
f |
F |
x,y,z |
1_555 |
58 |
25 |
17322 |
435.4 |
-1.2 |
0.625 |
9 |
0 |
0 |
0.035 |
12 |
13 |
|
[GTP]A:501 |
32 |
1 |
630 |
f |
A |
x,y,z |
1_555 |
62 |
29 |
17625 |
416.2 |
-2.9 |
0.543 |
19 |
0 |
0 |
0.287 |
14 |
|
[GTP]C:501 |
32 |
1 |
631 |
f |
C |
x,y,z |
1_555 |
66 |
30 |
17901 |
406.6 |
-2.6 |
0.579 |
20 |
0 |
0 |
0.287 |
Average: |
411.4 |
-2.8 |
0.561 |
20 |
0 |
0 |
0.287 |
13 |
15 |
|
[GDP]D:501 |
28 |
1 |
563 |
f |
D |
x,y,z |
1_555 |
60 |
26 |
17309 |
399.8 |
-6.8 |
0.503 |
9 |
0 |
0 |
0.170 |
16 |
|
[GDP]B:501 |
27 |
1 |
564 |
f |
B |
x,y,z |
1_555 |
66 |
28 |
17809 |
399.8 |
-6.8 |
0.553 |
11 |
0 |
0 |
0.170 |
Average: |
399.8 |
-6.8 |
0.528 |
10 |
0 |
0 |
0.170 |
14 |
17 |
|
C |
35 |
12 |
17901 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
36 |
13 |
17625 |
328.7 |
-1.4 |
0.505 |
3 |
1 |
0 |
0.000 |
15 |
18 |
|
C |
34 |
9 |
17901 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
37 |
11 |
17625 |
299.8 |
0.2 |
0.643 |
2 |
1 |
0 |
0.000 |
16 |
19 |
|
C |
33 |
12 |
17901 |
◊ |
E |
-x+1/2,-y+1,z-1/2 |
2_564 |
26 |
6 |
12520 |
246.1 |
-1.1 |
0.538 |
2 |
0 |
0 |
0.000 |
17 |
20 |
|
B |
27 |
6 |
17809 |
◊ |
D |
x-1/2,-y+1/2,-z |
4_455 |
31 |
9 |
17309 |
244.7 |
-0.7 |
0.511 |
1 |
4 |
0 |
0.000 |
18 |
21 |
|
D |
22 |
5 |
17309 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
24 |
8 |
17625 |
205.0 |
1.2 |
0.751 |
1 |
6 |
0 |
0.000 |
19 |
22 |
|
C |
27 |
7 |
17901 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
31 |
10 |
17809 |
198.0 |
-0.8 |
0.521 |
1 |
0 |
0 |
0.000 |
20 |
23 |
|
[MES]B:504 |
12 |
1 |
333 |
◊ |
B |
x,y,z |
1_555 |
29 |
12 |
17809 |
191.9 |
7.2 |
0.392 |
0 |
0 |
0 |
0.000 |
21 |
24 |
|
[HR8]B:505 |
11 |
1 |
424 |
f |
B |
x,y,z |
1_555 |
27 |
8 |
17809 |
159.6 |
-3.4 |
0.416 |
0 |
0 |
0 |
0.050 |
22 |
25 |
|
D |
21 |
8 |
17309 |
◊ |
E |
x-1/2,-y+1/2,-z |
4_455 |
18 |
9 |
12520 |
157.9 |
3.2 |
0.868 |
3 |
4 |
0 |
0.000 |
23 |
26 |
|
B |
17 |
5 |
17809 |
◊ |
E |
x-1/2,-y+1/2,-z |
4_455 |
21 |
8 |
12520 |
157.2 |
-0.1 |
0.662 |
1 |
3 |
0 |
0.000 |
24 |
27 |
|
[HR8]B:505 |
7 |
1 |
424 |
◊ |
C |
x,y,z |
1_555 |
16 |
7 |
17901 |
113.5 |
-0.9 |
0.371 |
0 |
0 |
0 |
0.013 |
25 |
28 |
|
A |
11 |
4 |
17625 |
◊ |
F |
-x+1/2,-y+1,z-1/2 |
2_564 |
8 |
2 |
17322 |
113.4 |
0.7 |
0.599 |
1 |
2 |
0 |
0.000 |
26 |
29 |
|
C |
7 |
3 |
17901 |
x |
C |
x-1/2,-y+1/2,-z |
4_455 |
20 |
8 |
17901 |
88.8 |
0.6 |
0.745 |
3 |
0 |
0 |
0.000 |
27 |
30 |
|
[GTP]C:501 |
9 |
1 |
631 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
17309 |
56.7 |
1.0 |
0.776 |
1 |
0 |
0 |
0.000 |
31 |
|
[GTP]A:501 |
6 |
1 |
630 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
17809 |
35.2 |
0.5 |
0.738 |
1 |
0 |
0 |
0.000 |
Average: |
45.9 |
0.8 |
0.757 |
1 |
0 |
0 |
0.000 |
28 |
32 |
|
[MG]B:502 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
17809 |
52.6 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.075 |
33 |
|
[MG]D:502 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
5 |
3 |
17309 |
42.2 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.075 |
Average: |
47.4 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.075 |
29 |
34 |
|
B |
6 |
3 |
17809 |
◊ |
E |
-x+1/2,-y+1,z-1/2 |
2_564 |
4 |
2 |
12520 |
44.5 |
-0.6 |
0.391 |
0 |
0 |
0 |
0.000 |
30 |
35 |
|
[CA]A:504 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
17625 |
42.8 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.121 |
31 |
36 |
|
[MG]C:502 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
12 |
5 |
17901 |
42.2 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.125 |
37 |
|
[MG]A:502 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
17625 |
41.9 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.125 |
Average: |
42.0 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.125 |
32 |
38 |
|
[ACP]F:401 |
3 |
1 |
612 |
f |
[MG]F:402 |
x,y,z |
1_555 |
1 |
1 |
98 |
39.4 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.037 |
33 |
39 |
|
[MES]B:504 |
5 |
1 |
333 |
◊ |
A |
x,y,z |
1_555 |
6 |
4 |
17625 |
39.0 |
0.3 |
0.043 |
0 |
0 |
0 |
0.000 |
34 |
40 |
|
[MG]F:402 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
5 |
3 |
17322 |
37.5 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.027 |
35 |
41 |
|
C |
9 |
5 |
17901 |
f |
[CA]B:503 |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
85 |
33.4 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.148 |
36 |
42 |
|
[MG]A:502 |
1 |
1 |
98 |
f |
[GTP]A:501 |
x,y,z |
1_555 |
5 |
1 |
630 |
32.0 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.105 |
43 |
|
[MG]C:502 |
1 |
1 |
98 |
f |
[GTP]C:501 |
x,y,z |
1_555 |
4 |
1 |
631 |
31.5 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.105 |
Average: |
31.7 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.105 |
37 |
44 |
|
[GDP]D:501 |
6 |
1 |
563 |
f |
[MG]D:502 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.0 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.068 |
45 |
|
[GDP]B:501 |
5 |
1 |
564 |
f |
[MG]B:502 |
x,y,z |
1_555 |
1 |
1 |
98 |
26.2 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.068 |
Average: |
28.6 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.068 |
38 |
46 |
|
[CA]B:503 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
17809 |
27.3 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.000 |
39 |
47 |
|
B |
1 |
1 |
17809 |
◊ |
F |
-x+1/2,-y+1,z-1/2 |
2_564 |
3 |
1 |
17322 |
20.4 |
-0.5 |
0.183 |
0 |
0 |
0 |
0.000 |
40 |
48 |
|
[MG]A:502 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
17809 |
15.7 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.011 |
49 |
|
[MG]C:502 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
17309 |
13.4 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.011 |
Average: |
14.6 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.011 |
41 |
50 |
|
[CA]A:504 |
1 |
1 |
85 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
12520 |
14.8 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.038 |
42 |
51 |
|
[MG]B:502 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
17901 |
12.4 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.016 |
43 |
52 |
|
[MES]B:504 |
2 |
1 |
333 |
f |
E |
x,y,z |
1_555 |
1 |
1 |
12520 |
6.6 |
0.1 |
0.176 |
0 |
0 |
0 |
0.000 |
44 |
53 |
|
[HR8]B:505 |
2 |
1 |
424 |
f |
[GDP]B:501 |
x,y,z |
1_555 |
1 |
1 |
564 |
3.7 |
-0.1 |
0.378 |
0 |
0 |
0 |
0.001 |
|