## |
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 |
141 |
35 |
12579 |
◊ |
A |
x,y,z |
1_555 |
176 |
48 |
17763 |
1529.5 |
-18.5 |
0.144 |
19 |
4 |
0 |
0.403 |
2 |
2 |
|
D |
143 |
38 |
17318 |
◊ |
C |
x,y,z |
1_555 |
142 |
33 |
17997 |
1339.7 |
-12.3 |
0.166 |
15 |
11 |
0 |
0.293 |
3 |
|
B |
142 |
38 |
17893 |
◊ |
A |
x,y,z |
1_555 |
141 |
34 |
17763 |
1336.9 |
-15.1 |
0.065 |
13 |
10 |
0 |
0.293 |
Average: |
1338.3 |
-13.7 |
0.116 |
14 |
11 |
0 |
0.293 |
3 |
4 |
|
B |
94 |
28 |
17893 |
◊ |
C |
x,y,z |
1_555 |
113 |
29 |
17997 |
896.4 |
-7.4 |
0.261 |
16 |
3 |
0 |
0.231 |
4 |
5 |
|
D |
98 |
27 |
17318 |
◊ |
F |
-x,y-1/2,-z+1/2 |
3_545 |
93 |
23 |
17480 |
868.9 |
5.3 |
0.838 |
14 |
4 |
0 |
0.000 |
5 |
6 |
|
E |
71 |
16 |
12579 |
◊ |
C |
x,y,z |
1_555 |
83 |
23 |
17997 |
769.9 |
-9.6 |
0.193 |
7 |
4 |
0 |
0.329 |
6 |
7 |
|
F |
77 |
22 |
17480 |
◊ |
A |
x,y,z |
1_555 |
88 |
23 |
17763 |
746.9 |
-1.3 |
0.616 |
7 |
6 |
0 |
0.000 |
7 |
8 |
|
E |
59 |
16 |
12579 |
◊ |
D |
x,y,z |
1_555 |
81 |
22 |
17318 |
679.7 |
-4.0 |
0.506 |
6 |
5 |
0 |
0.081 |
8 |
9 |
|
E |
62 |
15 |
12579 |
◊ |
B |
x,y,z |
1_555 |
79 |
21 |
17893 |
658.6 |
-2.8 |
0.552 |
5 |
5 |
0 |
0.052 |
9 |
10 |
|
C |
57 |
18 |
17997 |
◊ |
E |
x-1/2,-y+1/2,-z |
4_455 |
48 |
12 |
12579 |
498.1 |
-1.5 |
0.607 |
6 |
5 |
0 |
0.000 |
10 |
11 |
|
F |
50 |
13 |
17480 |
◊ |
B |
x,y,z |
1_555 |
49 |
12 |
17893 |
459.4 |
0.3 |
0.668 |
4 |
1 |
0 |
0.000 |
11 |
12 |
|
[ACP]F:401 |
31 |
1 |
612 |
f |
F |
x,y,z |
1_555 |
55 |
24 |
17480 |
430.6 |
-0.6 |
0.631 |
9 |
0 |
0 |
0.032 |
12 |
13 |
|
[GTP]A:501 |
32 |
1 |
627 |
f |
A |
x,y,z |
1_555 |
65 |
29 |
17763 |
416.3 |
-2.9 |
0.559 |
18 |
0 |
0 |
0.272 |
14 |
|
[GTP]C:501 |
32 |
1 |
633 |
f |
C |
x,y,z |
1_555 |
68 |
30 |
17997 |
408.8 |
-2.6 |
0.585 |
19 |
0 |
0 |
0.272 |
Average: |
412.5 |
-2.7 |
0.572 |
19 |
0 |
0 |
0.272 |
13 |
15 |
|
[GDP]D:501 |
28 |
1 |
565 |
f |
D |
x,y,z |
1_555 |
62 |
27 |
17318 |
404.4 |
-7.3 |
0.501 |
11 |
0 |
0 |
0.195 |
16 |
|
[GDP]B:501 |
27 |
1 |
564 |
f |
B |
x,y,z |
1_555 |
64 |
28 |
17893 |
402.4 |
-6.8 |
0.546 |
13 |
0 |
0 |
0.195 |
Average: |
403.4 |
-7.1 |
0.523 |
12 |
0 |
0 |
0.195 |
14 |
17 |
|
C |
35 |
12 |
17997 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
33 |
12 |
17763 |
314.3 |
-1.5 |
0.481 |
2 |
1 |
0 |
0.000 |
15 |
18 |
|
C |
36 |
9 |
17997 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
33 |
10 |
17763 |
294.4 |
-0.0 |
0.646 |
1 |
1 |
0 |
0.000 |
16 |
19 |
|
C |
31 |
11 |
17997 |
◊ |
E |
-x+1/2,-y+1,z-1/2 |
2_564 |
25 |
5 |
12579 |
235.1 |
-1.1 |
0.537 |
3 |
0 |
0 |
0.000 |
17 |
20 |
|
B |
24 |
6 |
17893 |
◊ |
D |
x-1/2,-y+1/2,-z |
4_455 |
29 |
7 |
17318 |
228.5 |
-0.9 |
0.464 |
1 |
4 |
0 |
0.000 |
18 |
21 |
|
C |
25 |
6 |
17997 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
29 |
9 |
17893 |
204.1 |
-0.4 |
0.567 |
1 |
1 |
0 |
0.000 |
19 |
22 |
|
D |
20 |
5 |
17318 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
23 |
8 |
17763 |
198.8 |
0.8 |
0.709 |
1 |
5 |
0 |
0.000 |
20 |
23 |
|
[MES]B:504 |
12 |
1 |
334 |
◊ |
B |
x,y,z |
1_555 |
26 |
12 |
17893 |
190.7 |
7.1 |
0.393 |
0 |
0 |
0 |
0.000 |
21 |
24 |
|
D |
22 |
8 |
17318 |
◊ |
E |
x-1/2,-y+1/2,-z |
4_455 |
18 |
9 |
12579 |
177.6 |
3.5 |
0.878 |
3 |
5 |
0 |
0.000 |
22 |
25 |
|
[UQJ]B:506 |
12 |
1 |
318 |
◊ |
B |
x,y,z |
1_555 |
27 |
8 |
17893 |
172.1 |
1.1 |
0.295 |
3 |
0 |
0 |
0.004 |
23 |
26 |
|
[UQJ]B:505 |
12 |
1 |
321 |
f |
B |
x,y,z |
1_555 |
28 |
9 |
17893 |
165.4 |
1.2 |
0.331 |
1 |
0 |
0 |
0.000 |
24 |
27 |
|
B |
16 |
6 |
17893 |
◊ |
E |
x-1/2,-y+1/2,-z |
4_455 |
19 |
9 |
12579 |
158.3 |
0.3 |
0.709 |
0 |
3 |
0 |
0.000 |
25 |
28 |
|
A |
11 |
4 |
17763 |
◊ |
F |
-x+1/2,-y+1,z-1/2 |
2_564 |
8 |
3 |
17480 |
110.6 |
0.7 |
0.603 |
2 |
2 |
0 |
0.000 |
26 |
29 |
|
[UQJ]B:506 |
5 |
1 |
318 |
f |
C |
x,y,z |
1_555 |
13 |
3 |
17997 |
77.5 |
0.2 |
0.335 |
2 |
0 |
0 |
0.018 |
27 |
30 |
|
C |
6 |
3 |
17997 |
x |
C |
x-1/2,-y+1/2,-z |
4_455 |
14 |
7 |
17997 |
75.9 |
0.7 |
0.764 |
3 |
0 |
0 |
0.000 |
28 |
31 |
|
[GTP]C:501 |
9 |
1 |
633 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
17318 |
56.5 |
1.1 |
0.788 |
1 |
0 |
0 |
0.000 |
32 |
|
[GTP]A:501 |
6 |
1 |
627 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
17893 |
33.6 |
0.5 |
0.746 |
1 |
0 |
0 |
0.000 |
Average: |
45.1 |
0.8 |
0.767 |
1 |
0 |
0 |
0.000 |
29 |
33 |
|
B |
9 |
4 |
17893 |
◊ |
E |
-x+1/2,-y+1,z-1/2 |
2_564 |
4 |
2 |
12579 |
54.3 |
-0.8 |
0.410 |
0 |
0 |
0 |
0.000 |
30 |
34 |
|
[MG]B:502 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
17893 |
51.8 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.077 |
35 |
|
[MG]D:502 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
5 |
3 |
17318 |
48.5 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.077 |
Average: |
50.1 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.077 |
31 |
36 |
|
[CA]A:503 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
17763 |
42.5 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.187 |
32 |
37 |
|
[MG]A:502 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
17763 |
42.1 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.117 |
38 |
|
[MG]C:502 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
12 |
6 |
17997 |
41.8 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.117 |
Average: |
42.0 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.117 |
33 |
39 |
|
[MG]F:402 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
5 |
3 |
17480 |
41.9 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.034 |
34 |
40 |
|
[CA]A:504 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
17763 |
37.5 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.089 |
35 |
41 |
|
[ACP]F:401 |
3 |
1 |
612 |
f |
[MG]F:402 |
x,y,z |
1_555 |
1 |
1 |
98 |
36.4 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.034 |
36 |
42 |
|
[MES]B:504 |
4 |
1 |
334 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
17763 |
36.3 |
0.3 |
0.080 |
0 |
0 |
0 |
0.000 |
37 |
43 |
|
C |
8 |
5 |
17997 |
f |
[CA]B:503 |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
85 |
35.7 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.158 |
38 |
44 |
|
[MG]C:502 |
1 |
1 |
98 |
f |
[GTP]C:501 |
x,y,z |
1_555 |
5 |
1 |
633 |
32.4 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.107 |
45 |
|
[MG]A:502 |
1 |
1 |
98 |
f |
[GTP]A:501 |
x,y,z |
1_555 |
5 |
1 |
627 |
32.1 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.107 |
Average: |
32.2 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.107 |
39 |
46 |
|
[GDP]B:501 |
6 |
1 |
564 |
f |
[MG]B:502 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.9 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.075 |
47 |
|
[GDP]D:501 |
4 |
1 |
565 |
f |
[MG]D:502 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.8 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.075 |
Average: |
31.9 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.075 |
40 |
48 |
|
[CA]B:503 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
17893 |
28.8 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.000 |
41 |
49 |
|
[UQJ]B:505 |
3 |
1 |
321 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
17997 |
25.7 |
0.1 |
0.266 |
0 |
0 |
0 |
0.000 |
42 |
50 |
|
B |
1 |
1 |
17893 |
◊ |
F |
-x+1/2,-y+1,z-1/2 |
2_564 |
3 |
1 |
17480 |
22.7 |
-0.6 |
0.156 |
0 |
0 |
0 |
0.000 |
43 |
51 |
|
[CA]A:504 |
1 |
1 |
85 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
12579 |
15.8 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.033 |
44 |
52 |
|
[MG]C:502 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
17318 |
13.1 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.009 |
53 |
|
[MG]A:502 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
17893 |
12.9 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.009 |
Average: |
13.0 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.009 |
45 |
54 |
|
[MG]B:502 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
17997 |
8.1 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.009 |
46 |
55 |
|
[MES]B:504 |
1 |
1 |
334 |
f |
E |
x,y,z |
1_555 |
1 |
1 |
12579 |
2.8 |
0.1 |
0.354 |
0 |
0 |
0 |
0.000 |
47 |
56 |
|
[UQJ]B:505 |
1 |
1 |
321 |
f |
[GDP]B:501 |
x,y,z |
1_555 |
1 |
1 |
564 |
1.5 |
-0.1 |
0.304 |
0 |
0 |
0 |
0.002 |
|