## |
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 |
|
J |
245 |
64 |
14407 |
◊ |
F |
x,y,z |
1_555 |
249 |
71 |
14427 |
2441.6 |
-32.9 |
0.041 |
32 |
6 |
0 |
0.977 |
2 |
|
D |
242 |
69 |
14745 |
◊ |
C |
x,y,z |
1_555 |
235 |
62 |
14112 |
2345.6 |
-29.6 |
0.071 |
33 |
6 |
0 |
0.977 |
3 |
|
H |
235 |
67 |
14542 |
◊ |
G |
x,y,z |
1_555 |
225 |
56 |
14205 |
2219.2 |
-28.1 |
0.066 |
32 |
6 |
0 |
0.977 |
4 |
|
G |
231 |
67 |
14205 |
◊ |
F |
x,y,z |
1_555 |
223 |
55 |
14427 |
2212.0 |
-28.7 |
0.061 |
30 |
7 |
0 |
0.977 |
5 |
|
E |
231 |
67 |
14374 |
◊ |
D |
x,y,z |
1_555 |
225 |
55 |
14745 |
2208.4 |
-28.0 |
0.059 |
31 |
5 |
0 |
0.977 |
6 |
|
I |
231 |
66 |
14107 |
◊ |
H |
x,y,z |
1_555 |
225 |
56 |
14542 |
2203.9 |
-29.1 |
0.060 |
31 |
6 |
0 |
0.977 |
7 |
|
E |
221 |
56 |
14374 |
◊ |
A |
x,y,z |
1_555 |
231 |
65 |
14544 |
2193.4 |
-28.6 |
0.052 |
30 |
6 |
0 |
0.977 |
8 |
|
C |
227 |
65 |
14112 |
◊ |
B |
x,y,z |
1_555 |
223 |
55 |
14503 |
2192.9 |
-28.1 |
0.070 |
30 |
6 |
0 |
0.977 |
9 |
|
B |
232 |
68 |
14503 |
◊ |
A |
x,y,z |
1_555 |
219 |
55 |
14544 |
2172.7 |
-29.1 |
0.049 |
29 |
6 |
0 |
0.977 |
10 |
|
J |
230 |
65 |
14407 |
◊ |
I |
x,y,z |
1_555 |
227 |
57 |
14107 |
2167.2 |
-28.8 |
0.062 |
29 |
6 |
0 |
0.977 |
Average: |
2235.7 |
-29.1 |
0.059 |
31 |
6 |
0 |
0.977 |
2 |
11 |
|
H |
68 |
22 |
14542 |
◊ |
J |
-x-1,y-1/2,-z-2 |
2_443 |
62 |
24 |
14407 |
584.4 |
-4.9 |
0.371 |
5 |
2 |
0 |
0.000 |
12 |
|
C |
51 |
21 |
14112 |
◊ |
A |
-x-1,y-1/2,-z-1 |
2_444 |
60 |
18 |
14544 |
506.2 |
-4.0 |
0.319 |
5 |
2 |
0 |
0.000 |
Average: |
545.3 |
-4.5 |
0.345 |
5 |
2 |
0 |
0.000 |
3 |
13 |
|
H |
48 |
13 |
14542 |
◊ |
F |
-x-1,y-1/2,-z-2 |
2_443 |
37 |
11 |
14427 |
409.9 |
-3.2 |
0.467 |
6 |
2 |
0 |
0.000 |
14 |
|
D |
29 |
8 |
14745 |
◊ |
A |
-x-1,y-1/2,-z-1 |
2_444 |
44 |
14 |
14544 |
366.3 |
-3.5 |
0.382 |
5 |
1 |
0 |
0.000 |
Average: |
388.1 |
-3.3 |
0.424 |
6 |
2 |
0 |
0.000 |
4 |
15 |
|
J |
40 |
14 |
14407 |
◊ |
E |
x-1,y,z-1 |
1_454 |
45 |
12 |
14374 |
401.3 |
-1.8 |
0.593 |
3 |
0 |
0 |
0.000 |
5 |
16 |
|
[SIA]C:402 |
18 |
1 |
448 |
f |
C |
x,y,z |
1_555 |
30 |
10 |
14112 |
210.5 |
-0.8 |
0.464 |
5 |
0 |
0 |
0.100 |
17 |
|
[SIA]J:402 |
17 |
1 |
451 |
f |
J |
x,y,z |
1_555 |
34 |
10 |
14407 |
210.4 |
-0.9 |
0.478 |
4 |
0 |
0 |
0.100 |
18 |
|
[SIA]B:401 |
17 |
1 |
448 |
f |
B |
x,y,z |
1_555 |
33 |
11 |
14503 |
207.1 |
-0.8 |
0.483 |
5 |
0 |
0 |
0.100 |
Average: |
209.3 |
-0.8 |
0.475 |
5 |
0 |
0 |
0.100 |
6 |
19 |
|
G |
20 |
8 |
14205 |
◊ |
C |
x-1,y,z |
1_455 |
25 |
9 |
14112 |
207.9 |
0.5 |
0.759 |
1 |
1 |
0 |
0.000 |
7 |
20 |
|
G |
24 |
6 |
14205 |
◊ |
C |
x,y,z |
1_555 |
28 |
10 |
14112 |
189.8 |
-0.2 |
0.694 |
1 |
0 |
0 |
0.000 |
8 |
21 |
|
J |
20 |
10 |
14407 |
◊ |
E |
x,y,z-1 |
1_554 |
17 |
5 |
14374 |
171.0 |
0.9 |
0.794 |
5 |
0 |
0 |
0.000 |
9 |
22 |
|
G |
10 |
3 |
14205 |
◊ |
H |
x-1,y,z |
1_455 |
10 |
3 |
14542 |
113.1 |
1.2 |
0.817 |
1 |
0 |
0 |
0.000 |
23 |
|
A |
10 |
3 |
14544 |
◊ |
E |
x-1,y,z |
1_455 |
10 |
3 |
14374 |
109.4 |
0.7 |
0.776 |
2 |
0 |
0 |
0.000 |
Average: |
111.2 |
0.9 |
0.796 |
2 |
0 |
0 |
0.000 |
10 |
24 |
|
[GOL]A:401 |
5 |
1 |
222 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
14544 |
104.4 |
-0.7 |
0.463 |
2 |
0 |
0 |
0.100 |
25 |
|
[GOL]E:401 |
5 |
1 |
221 |
f |
E |
x,y,z |
1_555 |
16 |
6 |
14374 |
104.2 |
-0.8 |
0.453 |
2 |
0 |
0 |
0.100 |
Average: |
104.3 |
-0.8 |
0.458 |
2 |
0 |
0 |
0.100 |
11 |
26 |
|
[GOL]C:401 |
5 |
1 |
221 |
f |
B |
x,y,z |
1_555 |
18 |
6 |
14503 |
103.7 |
-1.0 |
0.442 |
1 |
0 |
0 |
0.032 |
12 |
27 |
|
[GOL]H:401 |
5 |
1 |
220 |
f |
H |
x,y,z |
1_555 |
17 |
6 |
14542 |
103.1 |
-0.9 |
0.456 |
2 |
0 |
0 |
0.100 |
13 |
28 |
|
[GOL]I:401 |
5 |
1 |
219 |
f |
I |
x,y,z |
1_555 |
16 |
6 |
14107 |
101.9 |
-0.9 |
0.465 |
2 |
0 |
0 |
0.100 |
14 |
29 |
|
[GOL]J:401 |
6 |
1 |
221 |
f |
J |
x,y,z |
1_555 |
15 |
5 |
14407 |
101.6 |
-0.8 |
0.437 |
1 |
0 |
0 |
0.033 |
15 |
30 |
|
[GOL]E:402 |
6 |
1 |
216 |
f |
D |
x,y,z |
1_555 |
16 |
6 |
14745 |
97.8 |
-0.9 |
0.490 |
3 |
0 |
0 |
0.100 |
16 |
31 |
|
H |
12 |
3 |
14542 |
x |
H |
x-1,y,z |
1_455 |
12 |
5 |
14542 |
96.2 |
0.8 |
0.782 |
0 |
0 |
0 |
0.000 |
32 |
|
A |
9 |
4 |
14544 |
x |
A |
x-1,y,z |
1_455 |
11 |
3 |
14544 |
89.3 |
0.5 |
0.755 |
0 |
0 |
0 |
0.000 |
Average: |
92.7 |
0.7 |
0.768 |
0 |
0 |
0 |
0.000 |
17 |
33 |
|
I |
10 |
3 |
14107 |
◊ |
D |
x,y,z-1 |
1_554 |
12 |
4 |
14745 |
94.5 |
-2.6 |
0.095 |
0 |
0 |
0 |
0.000 |
18 |
34 |
|
[GOL]E:402 |
5 |
1 |
216 |
◊ |
E |
x,y,z |
1_555 |
12 |
6 |
14374 |
84.7 |
1.0 |
0.760 |
4 |
0 |
0 |
0.004 |
19 |
35 |
|
[GOL]I:401 |
6 |
1 |
219 |
◊ |
J |
x,y,z |
1_555 |
13 |
5 |
14407 |
84.1 |
-0.3 |
0.606 |
1 |
0 |
0 |
0.003 |
20 |
36 |
|
[GOL]C:401 |
6 |
1 |
221 |
◊ |
C |
x,y,z |
1_555 |
13 |
5 |
14112 |
84.0 |
-0.3 |
0.568 |
2 |
0 |
0 |
0.005 |
21 |
37 |
|
[GOL]E:401 |
6 |
1 |
221 |
◊ |
A |
x,y,z |
1_555 |
13 |
5 |
14544 |
83.9 |
-0.4 |
0.536 |
1 |
0 |
0 |
0.007 |
38 |
|
[GOL]A:401 |
6 |
1 |
222 |
◊ |
B |
x,y,z |
1_555 |
13 |
5 |
14503 |
83.7 |
-0.4 |
0.537 |
1 |
0 |
0 |
0.007 |
Average: |
83.8 |
-0.4 |
0.537 |
1 |
0 |
0 |
0.007 |
22 |
39 |
|
[GOL]H:401 |
6 |
1 |
220 |
◊ |
I |
x,y,z |
1_555 |
13 |
5 |
14107 |
83.5 |
-0.4 |
0.537 |
1 |
0 |
0 |
0.004 |
23 |
40 |
|
I |
11 |
4 |
14107 |
◊ |
D |
x-1,y,z-1 |
1_454 |
9 |
3 |
14745 |
80.9 |
1.8 |
0.878 |
1 |
0 |
0 |
0.000 |
24 |
41 |
|
[EDO]G:401 |
4 |
1 |
184 |
f |
G |
x,y,z |
1_555 |
12 |
5 |
14205 |
77.0 |
1.8 |
0.238 |
1 |
0 |
0 |
0.000 |
25 |
42 |
|
D |
11 |
3 |
14745 |
◊ |
B |
-x-1,y-1/2,-z-1 |
2_444 |
9 |
2 |
14503 |
76.8 |
0.1 |
0.606 |
1 |
0 |
0 |
0.000 |
43 |
|
I |
3 |
1 |
14107 |
◊ |
F |
-x-1,y-1/2,-z-2 |
2_443 |
4 |
2 |
14427 |
37.7 |
1.1 |
0.879 |
2 |
0 |
0 |
0.000 |
Average: |
57.2 |
0.6 |
0.742 |
2 |
0 |
0 |
0.000 |
26 |
44 |
|
[GOL]J:401 |
5 |
1 |
221 |
◊ |
F |
x,y,z |
1_555 |
11 |
5 |
14427 |
75.1 |
0.6 |
0.680 |
4 |
0 |
0 |
0.005 |
27 |
45 |
|
H |
13 |
6 |
14542 |
◊ |
J |
-x-2,y-1/2,-z-2 |
2_343 |
8 |
3 |
14407 |
74.9 |
0.7 |
0.774 |
1 |
0 |
0 |
0.000 |
46 |
|
C |
7 |
3 |
14112 |
◊ |
A |
-x,y-1/2,-z-1 |
2_544 |
12 |
5 |
14544 |
74.6 |
0.8 |
0.808 |
1 |
0 |
0 |
0.000 |
Average: |
74.7 |
0.7 |
0.791 |
1 |
0 |
0 |
0.000 |
28 |
47 |
|
[EDO]G:401 |
4 |
1 |
184 |
◊ |
H |
x,y,z |
1_555 |
10 |
4 |
14542 |
73.0 |
2.3 |
0.296 |
1 |
0 |
0 |
0.000 |
29 |
48 |
|
F |
11 |
5 |
14427 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
14503 |
68.7 |
-1.1 |
0.201 |
1 |
0 |
0 |
0.000 |
30 |
49 |
|
[SIA]C:402 |
3 |
1 |
448 |
◊ |
B |
x,y,z |
1_555 |
7 |
2 |
14503 |
68.0 |
0.9 |
0.612 |
1 |
0 |
0 |
0.000 |
50 |
|
[SIA]B:401 |
3 |
1 |
448 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
14544 |
67.6 |
1.2 |
0.647 |
1 |
0 |
0 |
0.000 |
51 |
|
[SIA]J:402 |
3 |
1 |
451 |
◊ |
I |
x,y,z |
1_555 |
6 |
2 |
14107 |
67.0 |
0.8 |
0.615 |
1 |
0 |
0 |
0.000 |
Average: |
67.6 |
1.0 |
0.625 |
1 |
0 |
0 |
0.000 |
31 |
52 |
|
G |
6 |
2 |
14205 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
14503 |
57.2 |
-0.5 |
0.404 |
1 |
2 |
0 |
0.000 |
32 |
53 |
|
J |
5 |
2 |
14407 |
◊ |
D |
x-1,y,z-1 |
1_454 |
6 |
2 |
14745 |
56.7 |
0.9 |
0.830 |
1 |
1 |
0 |
0.000 |
33 |
54 |
|
E |
5 |
2 |
14374 |
x |
E |
x-1,y,z |
1_455 |
5 |
1 |
14374 |
50.0 |
0.1 |
0.647 |
0 |
0 |
0 |
0.000 |
55 |
|
G |
5 |
1 |
14205 |
x |
G |
x-1,y,z |
1_455 |
5 |
2 |
14205 |
49.1 |
0.2 |
0.685 |
0 |
0 |
0 |
0.000 |
Average: |
49.5 |
0.1 |
0.666 |
0 |
0 |
0 |
0.000 |
34 |
56 |
|
G |
4 |
3 |
14205 |
◊ |
E |
-x-1,y-1/2,-z-1 |
2_444 |
6 |
3 |
14374 |
48.3 |
0.6 |
0.656 |
1 |
0 |
0 |
0.000 |
35 |
57 |
|
B |
4 |
1 |
14503 |
◊ |
A |
x-1,y,z |
1_455 |
3 |
1 |
14544 |
30.1 |
-0.2 |
0.430 |
0 |
0 |
0 |
0.000 |
58 |
|
H |
3 |
1 |
14542 |
◊ |
I |
x-1,y,z |
1_455 |
3 |
1 |
14107 |
29.3 |
0.0 |
0.546 |
0 |
0 |
0 |
0.000 |
Average: |
29.7 |
-0.1 |
0.488 |
0 |
0 |
0 |
0.000 |
36 |
59 |
|
H |
3 |
2 |
14542 |
◊ |
F |
-x-2,y-1/2,-z-2 |
2_343 |
6 |
5 |
14427 |
24.7 |
0.5 |
0.690 |
0 |
0 |
0 |
0.000 |
60 |
|
D |
1 |
1 |
14745 |
◊ |
A |
-x,y-1/2,-z-1 |
2_544 |
1 |
1 |
14544 |
5.0 |
0.0 |
0.512 |
0 |
0 |
0 |
0.000 |
Average: |
14.8 |
0.2 |
0.601 |
0 |
0 |
0 |
0.000 |
37 |
61 |
|
I |
2 |
1 |
14107 |
◊ |
E |
x,y,z-1 |
1_554 |
2 |
1 |
14374 |
23.3 |
0.2 |
0.419 |
0 |
0 |
0 |
0.000 |
38 |
62 |
|
I |
4 |
2 |
14107 |
x |
I |
x-1,y,z |
1_455 |
2 |
2 |
14107 |
23.2 |
0.1 |
0.528 |
0 |
0 |
0 |
0.000 |
63 |
|
B |
1 |
1 |
14503 |
x |
B |
x-1,y,z |
1_455 |
3 |
1 |
14503 |
20.9 |
-0.1 |
0.299 |
0 |
0 |
0 |
0.000 |
Average: |
22.0 |
-0.0 |
0.414 |
0 |
0 |
0 |
0.000 |
39 |
64 |
|
B |
2 |
1 |
14503 |
◊ |
[SIA]B:401 |
x-1,y,z |
1_455 |
1 |
1 |
448 |
18.0 |
0.8 |
0.733 |
0 |
0 |
0 |
0.000 |
40 |
65 |
|
F |
2 |
1 |
14427 |
◊ |
G |
x-1,y,z |
1_455 |
2 |
1 |
14205 |
15.0 |
-0.1 |
0.479 |
0 |
0 |
0 |
0.000 |
66 |
|
E |
4 |
2 |
14374 |
◊ |
D |
x-1,y,z |
1_455 |
1 |
1 |
14745 |
12.3 |
0.4 |
0.709 |
0 |
0 |
0 |
0.000 |
Average: |
13.7 |
0.1 |
0.594 |
0 |
0 |
0 |
0.000 |
41 |
67 |
|
I |
3 |
2 |
14107 |
◊ |
E |
x-1,y,z-1 |
1_454 |
3 |
2 |
14374 |
12.8 |
0.5 |
0.815 |
0 |
0 |
0 |
0.000 |
42 |
68 |
|
I |
1 |
1 |
14107 |
◊ |
G |
x,y,z |
1_555 |
1 |
1 |
14205 |
12.8 |
0.3 |
0.854 |
0 |
0 |
0 |
0.000 |
69 |
|
H |
1 |
1 |
14542 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
14427 |
12.5 |
0.3 |
0.848 |
0 |
0 |
0 |
0.000 |
70 |
|
E |
1 |
1 |
14374 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
14503 |
12.5 |
0.3 |
0.848 |
0 |
0 |
0 |
0.000 |
71 |
|
J |
1 |
1 |
14407 |
◊ |
H |
x,y,z |
1_555 |
1 |
1 |
14542 |
12.4 |
0.3 |
0.850 |
0 |
0 |
0 |
0.000 |
72 |
|
E |
1 |
1 |
14374 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
14112 |
12.2 |
0.3 |
0.853 |
0 |
0 |
0 |
0.000 |
73 |
|
C |
1 |
1 |
14112 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
14544 |
12.2 |
0.3 |
0.850 |
0 |
0 |
0 |
0.000 |
74 |
|
J |
1 |
1 |
14407 |
◊ |
G |
x,y,z |
1_555 |
1 |
1 |
14205 |
12.1 |
0.3 |
0.848 |
0 |
0 |
0 |
0.000 |
75 |
|
D |
1 |
1 |
14745 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
14544 |
12.1 |
0.3 |
0.844 |
0 |
0 |
0 |
0.000 |
76 |
|
D |
1 |
1 |
14745 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
14503 |
12.1 |
0.3 |
0.843 |
0 |
0 |
0 |
0.000 |
77 |
|
I |
1 |
1 |
14107 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
14427 |
12.1 |
0.3 |
0.848 |
0 |
0 |
0 |
0.000 |
Average: |
12.3 |
0.3 |
0.848 |
0 |
0 |
0 |
0.000 |
43 |
78 |
|
F |
1 |
1 |
14427 |
x |
F |
x-1,y,z |
1_455 |
1 |
1 |
14427 |
8.4 |
0.2 |
0.832 |
0 |
0 |
0 |
0.000 |
44 |
79 |
|
F |
2 |
1 |
14427 |
◊ |
B |
x-1,y,z |
1_455 |
3 |
1 |
14503 |
4.4 |
0.1 |
0.652 |
0 |
0 |
0 |
0.000 |
45 |
80 |
|
F |
2 |
2 |
14427 |
◊ |
C |
x-1,y,z |
1_455 |
3 |
2 |
14112 |
3.4 |
0.1 |
0.706 |
0 |
0 |
0 |
0.000 |
|