## |
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 |
139 |
34 |
12610 |
◊ |
A |
x,y,z |
1_555 |
175 |
47 |
17628 |
1511.6 |
-19.1 |
0.117 |
20 |
3 |
0 |
0.456 |
2 |
2 |
|
D |
144 |
38 |
16962 |
◊ |
C |
x,y,z |
1_555 |
149 |
38 |
17714 |
1393.1 |
-16.0 |
0.069 |
14 |
11 |
0 |
0.317 |
3 |
|
B |
146 |
37 |
17124 |
◊ |
A |
x,y,z |
1_555 |
149 |
37 |
17628 |
1316.9 |
-15.8 |
0.068 |
12 |
11 |
0 |
0.317 |
Average: |
1355.0 |
-15.9 |
0.068 |
13 |
11 |
0 |
0.317 |
3 |
4 |
|
B |
91 |
27 |
17124 |
◊ |
C |
x,y,z |
1_555 |
108 |
30 |
17714 |
894.0 |
-8.2 |
0.227 |
15 |
3 |
0 |
0.254 |
4 |
5 |
|
F |
86 |
24 |
16433 |
◊ |
A |
x,y,z |
1_555 |
90 |
22 |
17628 |
818.8 |
-1.1 |
0.642 |
9 |
6 |
0 |
0.000 |
5 |
6 |
|
E |
73 |
17 |
12610 |
◊ |
C |
x,y,z |
1_555 |
84 |
25 |
17714 |
755.3 |
-10.1 |
0.166 |
6 |
3 |
0 |
0.388 |
6 |
7 |
|
D |
81 |
21 |
16962 |
◊ |
F |
-x,y-1/2,-z+1/2 |
4_545 |
76 |
21 |
16433 |
723.4 |
1.4 |
0.687 |
10 |
0 |
0 |
0.000 |
7 |
8 |
|
E |
56 |
16 |
12610 |
◊ |
D |
x,y,z |
1_555 |
79 |
22 |
16962 |
662.8 |
-5.8 |
0.374 |
4 |
4 |
0 |
0.085 |
8 |
9 |
|
E |
59 |
15 |
12610 |
◊ |
B |
x,y,z |
1_555 |
80 |
21 |
17124 |
632.4 |
-3.3 |
0.546 |
6 |
5 |
0 |
0.062 |
9 |
10 |
|
C |
68 |
19 |
17714 |
◊ |
E |
x-1/2,-y+1/2,-z |
3_455 |
48 |
12 |
12610 |
537.9 |
-2.8 |
0.522 |
7 |
3 |
0 |
0.000 |
10 |
11 |
|
[3H4]D:503 |
39 |
1 |
948 |
f |
D |
x,y,z |
1_555 |
76 |
20 |
16962 |
489.3 |
-8.2 |
0.508 |
5 |
0 |
0 |
0.138 |
11 |
12 |
|
F |
49 |
14 |
16433 |
◊ |
B |
x,y,z |
1_555 |
48 |
12 |
17124 |
453.5 |
-0.6 |
0.608 |
5 |
0 |
0 |
0.000 |
12 |
13 |
|
[ACP]F:401 |
31 |
1 |
627 |
f |
F |
x,y,z |
1_555 |
51 |
21 |
16433 |
421.6 |
-1.6 |
0.548 |
7 |
0 |
0 |
0.033 |
13 |
14 |
|
[GTP]A:501 |
32 |
1 |
633 |
f |
A |
x,y,z |
1_555 |
67 |
30 |
17628 |
415.2 |
-2.8 |
0.540 |
20 |
0 |
0 |
0.333 |
15 |
|
[GTP]C:501 |
31 |
1 |
633 |
f |
C |
x,y,z |
1_555 |
67 |
30 |
17714 |
412.8 |
-2.4 |
0.590 |
20 |
0 |
0 |
0.333 |
Average: |
414.0 |
-2.6 |
0.565 |
20 |
0 |
0 |
0.333 |
14 |
16 |
|
[GDP]B:501 |
27 |
1 |
560 |
f |
B |
x,y,z |
1_555 |
65 |
27 |
17124 |
400.4 |
-6.4 |
0.583 |
13 |
0 |
0 |
0.201 |
17 |
|
[GDP]D:501 |
28 |
1 |
565 |
f |
D |
x,y,z |
1_555 |
59 |
27 |
16962 |
398.0 |
-6.4 |
0.573 |
11 |
0 |
0 |
0.201 |
Average: |
399.2 |
-6.4 |
0.578 |
12 |
0 |
0 |
0.201 |
15 |
18 |
|
C |
53 |
14 |
17714 |
◊ |
A |
-x,y-1/2,-z+1/2 |
4_545 |
45 |
13 |
17628 |
378.2 |
-0.6 |
0.645 |
5 |
1 |
0 |
0.000 |
16 |
19 |
|
C |
38 |
12 |
17714 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
40 |
14 |
17628 |
320.5 |
-1.5 |
0.440 |
2 |
0 |
0 |
0.000 |
17 |
20 |
|
C |
34 |
13 |
17714 |
◊ |
E |
-x+1/2,-y+1,z-1/2 |
2_564 |
28 |
6 |
12610 |
265.1 |
-1.4 |
0.499 |
1 |
0 |
0 |
0.000 |
18 |
21 |
|
C |
25 |
5 |
17714 |
◊ |
B |
x-1/2,-y+1/2,-z |
3_455 |
26 |
8 |
17124 |
195.1 |
-0.9 |
0.514 |
1 |
0 |
0 |
0.000 |
19 |
22 |
|
[MES]B:503 |
12 |
1 |
333 |
◊ |
B |
x,y,z |
1_555 |
30 |
12 |
17124 |
180.2 |
6.3 |
0.429 |
0 |
0 |
0 |
0.000 |
20 |
23 |
|
D |
16 |
6 |
16962 |
◊ |
E |
x-1/2,-y+1/2,-z |
3_455 |
18 |
8 |
12610 |
148.0 |
2.2 |
0.852 |
2 |
3 |
0 |
0.000 |
21 |
24 |
|
B |
17 |
4 |
17124 |
◊ |
D |
x-1/2,-y+1/2,-z |
3_455 |
24 |
7 |
16962 |
133.9 |
-2.0 |
0.284 |
0 |
0 |
0 |
0.000 |
22 |
25 |
|
[GOL]B:504 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
21 |
10 |
17124 |
127.8 |
-0.4 |
0.527 |
4 |
0 |
0 |
0.035 |
23 |
26 |
|
B |
14 |
3 |
17124 |
◊ |
E |
x-1/2,-y+1/2,-z |
3_455 |
10 |
4 |
12610 |
122.0 |
0.2 |
0.670 |
1 |
5 |
0 |
0.000 |
24 |
27 |
|
C |
12 |
4 |
17714 |
x |
C |
x-1/2,-y+1/2,-z |
3_455 |
19 |
7 |
17714 |
97.4 |
1.2 |
0.742 |
1 |
0 |
0 |
0.000 |
25 |
28 |
|
[GOL]A:504 |
5 |
1 |
219 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
17628 |
75.9 |
0.1 |
0.625 |
1 |
0 |
0 |
0.005 |
26 |
29 |
|
B |
8 |
4 |
17124 |
◊ |
E |
-x+1/2,-y+1,z-1/2 |
2_564 |
6 |
2 |
12610 |
52.8 |
-0.3 |
0.544 |
0 |
0 |
0 |
0.000 |
27 |
30 |
|
[MG]B:502 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
17124 |
51.2 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.083 |
31 |
|
[MG]D:502 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
4 |
2 |
16962 |
39.7 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.083 |
Average: |
45.4 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.083 |
28 |
32 |
|
[GTP]C:501 |
7 |
1 |
633 |
◊ |
D |
x,y,z |
1_555 |
3 |
2 |
16962 |
46.8 |
0.9 |
0.778 |
1 |
0 |
0 |
0.000 |
33 |
|
[GTP]A:501 |
8 |
1 |
633 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
17124 |
43.4 |
0.8 |
0.770 |
1 |
0 |
0 |
0.000 |
Average: |
45.1 |
0.9 |
0.774 |
1 |
0 |
0 |
0.000 |
29 |
34 |
|
[MG]F:402 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
5 |
3 |
16433 |
43.6 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.033 |
30 |
35 |
|
[CA]A:503 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
5 |
5 |
17628 |
42.9 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.204 |
31 |
36 |
|
[MG]C:502 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
13 |
6 |
17714 |
42.6 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.144 |
37 |
|
[MG]A:502 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
17628 |
42.1 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.144 |
Average: |
42.3 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.144 |
32 |
38 |
|
[GOL]A:504 |
4 |
1 |
219 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
17124 |
40.9 |
-0.2 |
0.519 |
0 |
0 |
0 |
0.001 |
33 |
39 |
|
[MES]B:503 |
5 |
1 |
333 |
f |
[GOL]A:504 |
x,y,z |
1_555 |
3 |
1 |
219 |
39.9 |
0.8 |
0.053 |
0 |
0 |
0 |
0.000 |
34 |
40 |
|
[MES]B:503 |
3 |
1 |
333 |
◊ |
[GOL]B:504 |
x,y,z |
1_555 |
3 |
1 |
220 |
39.2 |
1.6 |
0.487 |
0 |
0 |
0 |
0.000 |
35 |
41 |
|
[ACP]F:401 |
4 |
1 |
627 |
f |
[MG]F:402 |
x,y,z |
1_555 |
1 |
1 |
98 |
35.7 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.034 |
36 |
42 |
|
[GOL]A:504 |
4 |
1 |
219 |
f |
E |
x,y,z |
1_555 |
6 |
2 |
12610 |
34.9 |
-0.9 |
0.388 |
0 |
0 |
0 |
0.659 |
37 |
43 |
|
[GDP]D:501 |
4 |
1 |
565 |
f |
[MG]D:502 |
x,y,z |
1_555 |
1 |
1 |
98 |
34.8 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.075 |
44 |
|
[GDP]B:501 |
7 |
1 |
560 |
f |
[MG]B:502 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.0 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.075 |
Average: |
32.9 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.075 |
38 |
45 |
|
[MG]C:502 |
1 |
1 |
98 |
f |
[GTP]C:501 |
x,y,z |
1_555 |
5 |
1 |
633 |
32.6 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.131 |
46 |
|
[MG]A:502 |
1 |
1 |
98 |
f |
[GTP]A:501 |
x,y,z |
1_555 |
5 |
1 |
633 |
32.3 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.131 |
Average: |
32.5 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.131 |
39 |
47 |
|
[MES]B:503 |
4 |
1 |
333 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
17628 |
27.7 |
0.3 |
0.087 |
0 |
0 |
0 |
0.000 |
40 |
48 |
|
[GOL]B:504 |
2 |
1 |
220 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
17628 |
17.3 |
-0.1 |
0.554 |
0 |
0 |
0 |
0.002 |
41 |
49 |
|
D |
3 |
2 |
16962 |
◊ |
A |
x-1/2,-y+1/2,-z |
3_455 |
2 |
2 |
17628 |
16.2 |
0.3 |
0.535 |
0 |
0 |
0 |
0.000 |
42 |
50 |
|
[MG]A:502 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
17124 |
13.2 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.008 |
51 |
|
[MG]C:502 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
16962 |
12.5 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.008 |
Average: |
12.8 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.008 |
43 |
52 |
|
D |
1 |
1 |
16962 |
◊ |
B |
x-1/2,-y+1/2,-z |
3_455 |
2 |
2 |
17124 |
9.9 |
0.2 |
0.793 |
0 |
0 |
0 |
0.000 |
44 |
53 |
|
[3H4]D:503 |
1 |
1 |
948 |
f |
[GDP]D:501 |
x,y,z |
1_555 |
1 |
1 |
565 |
8.9 |
-0.4 |
0.387 |
0 |
0 |
0 |
0.005 |
45 |
54 |
|
[MG]B:502 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
17714 |
8.6 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.011 |
46 |
55 |
|
[MES]B:503 |
3 |
1 |
333 |
f |
E |
x,y,z |
1_555 |
1 |
1 |
12610 |
3.6 |
-0.0 |
0.068 |
0 |
0 |
0 |
0.034 |
47 |
56 |
|
B |
1 |
1 |
17124 |
◊ |
F |
-x+1/2,-y+1,z-1/2 |
2_564 |
1 |
1 |
16433 |
0.5 |
0.0 |
0.678 |
0 |
0 |
0 |
0.000 |
|