| ## |
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 |
262 |
66 |
21256 |
◊ |
A |
x,y,z |
1_555 |
267 |
65 |
21244 |
2672.5 |
-45.9 |
0.001 |
26 |
0 |
0 |
1.000 |
2 |
|
D |
264 |
64 |
21446 |
◊ |
C |
x,y,z |
1_555 |
265 |
66 |
21460 |
2659.0 |
-45.3 |
0.001 |
29 |
1 |
0 |
1.000 |
| Average: |
2665.8 |
-45.6 |
0.001 |
28 |
1 |
0 |
1.000 |
| 2 |
3 |
|
F |
257 |
62 |
20859 |
◊ |
E |
x,y,z |
1_555 |
259 |
65 |
21355 |
2620.6 |
-43.7 |
0.001 |
27 |
1 |
0 |
1.000 |
| 3 |
4 |
|
E |
76 |
20 |
21355 |
◊ |
A |
x,y,z |
1_555 |
63 |
17 |
21244 |
706.9 |
-3.6 |
0.536 |
9 |
4 |
0 |
0.180 |
5 |
|
D |
74 |
20 |
21446 |
◊ |
B |
x,y,z |
1_555 |
64 |
17 |
21256 |
698.3 |
-3.5 |
0.537 |
10 |
4 |
0 |
0.180 |
6 |
|
E |
63 |
17 |
21355 |
◊ |
C |
x,y,z |
1_555 |
73 |
19 |
21460 |
691.5 |
-3.2 |
0.549 |
9 |
4 |
0 |
0.180 |
7 |
|
C |
62 |
17 |
21460 |
◊ |
A |
x,y,z |
1_555 |
67 |
19 |
21244 |
682.0 |
-3.0 |
0.560 |
9 |
4 |
0 |
0.180 |
| Average: |
694.7 |
-3.3 |
0.545 |
9 |
4 |
0 |
0.180 |
| 4 |
8 |
|
F |
76 |
21 |
20859 |
◊ |
D |
x,y,z |
1_555 |
63 |
17 |
21446 |
706.0 |
-4.0 |
0.486 |
10 |
4 |
0 |
0.051 |
| 5 |
9 |
|
B |
80 |
21 |
21256 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
75 |
21 |
21244 |
676.2 |
-4.1 |
0.553 |
7 |
9 |
0 |
0.000 |
| 6 |
10 |
|
F |
61 |
17 |
20859 |
◊ |
B |
x,y,z |
1_555 |
67 |
21 |
21256 |
649.1 |
-3.8 |
0.488 |
8 |
2 |
0 |
0.043 |
| 7 |
11 |
|
F |
36 |
16 |
20859 |
◊ |
D |
-x,y-1/2,-z-1/2 |
3_544 |
43 |
16 |
21446 |
347.1 |
1.1 |
0.783 |
3 |
1 |
0 |
0.000 |
| 8 |
12 |
|
F |
36 |
12 |
20859 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
41 |
11 |
21244 |
344.0 |
-0.9 |
0.569 |
1 |
0 |
0 |
0.000 |
| 9 |
13 |
|
B |
39 |
15 |
21256 |
◊ |
C |
x-1,y,z |
1_455 |
38 |
12 |
21460 |
316.7 |
-3.6 |
0.372 |
0 |
0 |
0 |
0.000 |
| 10 |
14 |
|
[PG4]F:467 |
13 |
1 |
399 |
◊ |
F |
x,y,z |
1_555 |
36 |
16 |
20859 |
278.4 |
5.2 |
0.394 |
3 |
0 |
0 |
0.000 |
| 11 |
15 |
|
F |
36 |
11 |
20859 |
◊ |
C |
x-1,y,z |
1_455 |
38 |
12 |
21460 |
262.6 |
2.8 |
0.896 |
4 |
3 |
0 |
0.000 |
| 12 |
16 |
|
E |
25 |
7 |
21355 |
◊ |
D |
-x+1,y-1/2,-z-1/2 |
3_644 |
30 |
12 |
21446 |
236.5 |
-0.1 |
0.701 |
4 |
1 |
0 |
0.000 |
| 13 |
17 |
|
[PG4]C:467 |
13 |
1 |
387 |
◊ |
C |
x,y,z |
1_555 |
35 |
13 |
21460 |
224.2 |
2.0 |
0.275 |
4 |
0 |
0 |
0.000 |
| 14 |
18 |
|
[PG4]A:467 |
12 |
1 |
387 |
◊ |
A |
x,y,z |
1_555 |
34 |
14 |
21244 |
219.6 |
2.3 |
0.297 |
2 |
0 |
0 |
0.000 |
| 15 |
19 |
|
[PG4]D:467 |
13 |
1 |
386 |
f |
D |
x,y,z |
1_555 |
34 |
11 |
21446 |
215.9 |
1.7 |
0.264 |
4 |
0 |
0 |
0.002 |
| 16 |
20 |
|
[PG4]C:468 |
12 |
1 |
402 |
◊ |
C |
x,y,z |
1_555 |
23 |
9 |
21460 |
160.7 |
2.5 |
0.277 |
0 |
0 |
0 |
0.000 |
| 17 |
21 |
|
B |
16 |
6 |
21256 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
15 |
7 |
21244 |
153.3 |
-0.5 |
0.555 |
1 |
0 |
0 |
0.000 |
| 18 |
22 |
|
F |
18 |
7 |
20859 |
◊ |
E |
x-1,y,z |
1_455 |
21 |
9 |
21355 |
146.9 |
1.3 |
0.825 |
1 |
0 |
0 |
0.000 |
| 19 |
23 |
|
E |
14 |
6 |
21355 |
◊ |
C |
x,y-1,z |
1_545 |
19 |
7 |
21460 |
141.8 |
-0.3 |
0.636 |
2 |
0 |
0 |
0.000 |
| 20 |
24 |
|
[EDO]F:468 |
4 |
1 |
184 |
f |
F |
x,y,z |
1_555 |
23 |
9 |
20859 |
126.5 |
3.8 |
0.534 |
3 |
0 |
0 |
0.000 |
| 21 |
25 |
|
E |
15 |
6 |
21355 |
◊ |
B |
x,y-1,z |
1_545 |
10 |
2 |
21256 |
117.3 |
-0.7 |
0.494 |
0 |
0 |
0 |
0.000 |
| 22 |
26 |
|
[EDO]D:470 |
4 |
1 |
186 |
◊ |
D |
x,y,z |
1_555 |
20 |
6 |
21446 |
113.3 |
3.7 |
0.509 |
4 |
0 |
0 |
0.000 |
| 23 |
27 |
|
[EDO]B:467 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
24 |
10 |
21256 |
107.9 |
1.6 |
0.359 |
0 |
0 |
0 |
0.000 |
| 24 |
28 |
|
[EDO]B:469 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
18 |
7 |
21256 |
100.4 |
3.2 |
0.540 |
1 |
0 |
0 |
0.000 |
| 25 |
29 |
|
[EDO]F:469 |
4 |
1 |
185 |
f |
F |
x,y,z |
1_555 |
13 |
5 |
20859 |
99.6 |
2.8 |
0.486 |
1 |
0 |
0 |
0.000 |
| 26 |
30 |
|
E |
12 |
5 |
21355 |
◊ |
D |
x,y-1,z |
1_545 |
13 |
7 |
21446 |
94.4 |
2.3 |
0.869 |
2 |
2 |
0 |
0.000 |
| 27 |
31 |
|
[EDO]E:467 |
4 |
1 |
187 |
f |
E |
x,y,z |
1_555 |
19 |
7 |
21355 |
92.7 |
1.2 |
0.201 |
0 |
0 |
0 |
0.000 |
| 28 |
32 |
|
[EDO]B:470 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
18 |
7 |
21256 |
91.2 |
1.3 |
0.203 |
0 |
0 |
0 |
0.000 |
| 29 |
33 |
|
[EDO]A:468 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
15 |
7 |
21244 |
89.9 |
3.2 |
0.321 |
3 |
0 |
0 |
0.000 |
| 30 |
34 |
|
[EDO]B:468 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
21 |
8 |
21256 |
88.4 |
2.2 |
0.293 |
2 |
0 |
0 |
0.000 |
| 31 |
35 |
|
[EDO]D:471 |
4 |
1 |
185 |
◊ |
F |
x,y,z |
1_555 |
12 |
7 |
20859 |
85.7 |
3.3 |
0.330 |
3 |
0 |
0 |
0.000 |
| 32 |
36 |
|
[EDO]D:468 |
4 |
1 |
186 |
◊ |
D |
x,y,z |
1_555 |
13 |
6 |
21446 |
76.8 |
2.1 |
0.287 |
1 |
0 |
0 |
0.000 |
| 33 |
37 |
|
[EDO]D:469 |
4 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
13 |
5 |
21446 |
74.0 |
1.4 |
0.702 |
0 |
0 |
0 |
0.000 |
| 34 |
38 |
|
[EDO]D:472 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
19 |
6 |
21446 |
72.4 |
1.6 |
0.775 |
0 |
0 |
0 |
0.000 |
| 35 |
39 |
|
[EDO]C:469 |
4 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
11 |
5 |
21460 |
71.4 |
1.2 |
0.615 |
0 |
0 |
0 |
0.000 |
| 36 |
40 |
|
[EDO]E:468 |
4 |
1 |
186 |
◊ |
E |
x,y,z |
1_555 |
14 |
6 |
21355 |
71.0 |
2.2 |
0.299 |
1 |
0 |
0 |
0.000 |
| 37 |
41 |
|
A |
7 |
3 |
21244 |
◊ |
E |
x-1/2,-y-1/2,-z |
4_445 |
9 |
3 |
21355 |
70.1 |
-0.3 |
0.547 |
0 |
0 |
0 |
0.000 |
| 38 |
42 |
|
[EDO]F:470 |
4 |
1 |
186 |
f |
F |
x,y,z |
1_555 |
12 |
5 |
20859 |
66.5 |
1.1 |
0.597 |
1 |
0 |
0 |
0.000 |
| 39 |
43 |
|
[EDO]E:469 |
4 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
14 |
5 |
21355 |
64.5 |
1.6 |
0.809 |
1 |
0 |
0 |
0.000 |
| 40 |
44 |
|
[PG4]C:468 |
7 |
1 |
402 |
f |
E |
x,y,z |
1_555 |
8 |
1 |
21355 |
54.8 |
0.8 |
0.209 |
0 |
0 |
0 |
0.000 |
| 41 |
45 |
|
F |
6 |
2 |
20859 |
◊ |
A |
x,y,z |
1_555 |
5 |
1 |
21244 |
49.4 |
-0.1 |
0.596 |
0 |
0 |
0 |
0.000 |
| 42 |
46 |
|
[EDO]D:468 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
8 |
1 |
21256 |
48.8 |
0.7 |
0.551 |
0 |
0 |
0 |
0.000 |
| 43 |
47 |
|
[EDO]D:471 |
4 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
8 |
1 |
21446 |
47.9 |
0.9 |
0.580 |
0 |
0 |
0 |
0.000 |
| 44 |
48 |
|
[EDO]E:468 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
7 |
1 |
21244 |
46.5 |
0.5 |
0.507 |
0 |
0 |
0 |
0.000 |
| 45 |
49 |
|
C |
5 |
1 |
21460 |
◊ |
B |
x,y,z |
1_555 |
5 |
1 |
21256 |
45.2 |
-0.2 |
0.559 |
0 |
0 |
0 |
0.002 |
50 |
|
E |
5 |
1 |
21355 |
◊ |
D |
x,y,z |
1_555 |
5 |
1 |
21446 |
43.7 |
-0.2 |
0.576 |
0 |
0 |
0 |
0.002 |
| Average: |
44.5 |
-0.2 |
0.568 |
0 |
0 |
0 |
0.002 |
| 46 |
51 |
|
[EDO]B:468 |
4 |
1 |
185 |
f |
A |
x-1/2,-y+1/2,-z |
4_455 |
8 |
2 |
21244 |
45.1 |
1.2 |
0.882 |
0 |
0 |
0 |
0.000 |
| 47 |
52 |
|
[EDO]A:468 |
4 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
8 |
1 |
21460 |
43.3 |
0.8 |
0.595 |
0 |
0 |
0 |
0.000 |
| 48 |
53 |
|
B |
5 |
3 |
21256 |
◊ |
A |
x-1,y,z |
1_455 |
5 |
2 |
21244 |
42.4 |
1.4 |
0.828 |
1 |
1 |
0 |
0.000 |
| 49 |
54 |
|
[EDO]D:470 |
2 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
7 |
2 |
21460 |
27.2 |
0.7 |
0.765 |
0 |
0 |
0 |
0.000 |
| 50 |
55 |
|
D |
3 |
1 |
21446 |
◊ |
C |
x-1,y,z |
1_455 |
6 |
2 |
21460 |
25.3 |
0.2 |
0.707 |
0 |
0 |
0 |
0.000 |
| 51 |
56 |
|
[EDO]B:469 |
3 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
7 |
2 |
21244 |
23.6 |
0.5 |
0.834 |
0 |
0 |
0 |
0.000 |
| 52 |
57 |
|
[PG4]F:467 |
2 |
1 |
399 |
f |
E |
x,y,z |
1_555 |
1 |
1 |
21355 |
11.0 |
0.9 |
0.454 |
0 |
0 |
0 |
0.000 |
| 53 |
58 |
|
[EDO]F:469 |
2 |
1 |
185 |
f |
[EDO]F:468 |
x,y,z |
1_555 |
2 |
1 |
184 |
9.7 |
0.3 |
1.000 |
0 |
0 |
0 |
0.000 |
| 54 |
59 |
|
[PG4]A:467 |
1 |
1 |
387 |
f |
B |
x,y,z |
1_555 |
2 |
1 |
21256 |
2.5 |
-0.0 |
0.409 |
0 |
0 |
0 |
0.000 |
| 55 |
60 |
|
[PG4]D:467 |
1 |
1 |
386 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
21460 |
0.7 |
-0.1 |
0.355 |
0 |
0 |
0 |
0.001 |
| 56 |
61 |
|
[PG4]C:467 |
1 |
1 |
387 |
f |
D |
x,y,z |
1_555 |
1 |
1 |
21446 |
0.3 |
-0.0 |
0.372 |
0 |
0 |
0 |
0.000 |
|