## |
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 |
48 |
16 |
7618 |
◊ |
A |
x,y,z |
1_555 |
47 |
18 |
7542 |
501.1 |
-8.2 |
0.082 |
0 |
0 |
0 |
0.000 |
2 |
|
C |
47 |
16 |
7581 |
◊ |
D |
-y+2,x+1,z+3/4 |
3_765 |
46 |
16 |
7552 |
495.0 |
-7.8 |
0.092 |
0 |
0 |
0 |
0.000 |
Average: |
498.1 |
-8.0 |
0.087 |
0 |
0 |
0 |
0.000 |
2 |
3 |
|
B |
37 |
12 |
7618 |
x |
B |
-y+1,x+1,z-1/4 |
3_664 |
38 |
11 |
7618 |
367.7 |
0.7 |
0.730 |
1 |
0 |
0 |
0.000 |
4 |
|
C |
38 |
11 |
7581 |
x |
C |
-y+2,x+1,z-1/4 |
3_764 |
40 |
12 |
7581 |
358.5 |
-0.3 |
0.642 |
1 |
0 |
0 |
0.000 |
5 |
|
D |
35 |
11 |
7552 |
x |
D |
-y+2,x+1,z-1/4 |
3_764 |
39 |
10 |
7552 |
335.8 |
-0.8 |
0.655 |
0 |
0 |
0 |
0.000 |
6 |
|
A |
38 |
10 |
7542 |
x |
A |
-y+1,x+1,z-1/4 |
3_664 |
38 |
13 |
7542 |
332.9 |
-1.2 |
0.643 |
1 |
0 |
0 |
0.000 |
Average: |
348.7 |
-0.4 |
0.667 |
1 |
0 |
0 |
0.000 |
3 |
7 |
|
E |
25 |
10 |
7561 |
◊ |
A |
x,y,z |
1_555 |
29 |
8 |
7542 |
274.0 |
-0.7 |
0.649 |
0 |
0 |
0 |
0.000 |
4 |
8 |
|
D |
24 |
9 |
7552 |
◊ |
A |
-y+1,x+1,z-1/4 |
3_664 |
24 |
9 |
7542 |
273.8 |
-5.8 |
0.046 |
0 |
0 |
0 |
0.000 |
5 |
9 |
|
D |
26 |
8 |
7552 |
◊ |
E |
-y+1,x+1,z-1/4 |
3_664 |
30 |
10 |
7561 |
251.0 |
-0.8 |
0.632 |
0 |
0 |
0 |
0.000 |
6 |
10 |
|
C |
25 |
9 |
7581 |
◊ |
A |
-y+1,x+1,z+3/4 |
3_665 |
27 |
8 |
7542 |
238.2 |
-2.6 |
0.196 |
1 |
0 |
0 |
0.000 |
11 |
|
D |
26 |
7 |
7552 |
◊ |
B |
x,y,z |
1_555 |
26 |
9 |
7618 |
233.9 |
-2.3 |
0.227 |
2 |
0 |
0 |
0.000 |
Average: |
236.0 |
-2.5 |
0.212 |
2 |
0 |
0 |
0.000 |
7 |
12 |
|
E |
27 |
11 |
7561 |
◊ |
C |
-y+2,x+1,z-1/4 |
3_764 |
30 |
11 |
7581 |
224.5 |
-2.2 |
0.401 |
0 |
0 |
0 |
0.000 |
8 |
13 |
|
E |
26 |
10 |
7561 |
◊ |
B |
-y+2,x+1,z-1/4 |
3_764 |
27 |
8 |
7618 |
222.2 |
0.2 |
0.741 |
1 |
0 |
0 |
0.000 |
9 |
14 |
|
D |
24 |
6 |
7552 |
◊ |
C |
x,y,z |
1_555 |
27 |
8 |
7581 |
219.2 |
-3.7 |
0.176 |
0 |
0 |
0 |
0.000 |
15 |
|
B |
25 |
7 |
7618 |
◊ |
A |
-y+1,x+1,z+3/4 |
3_665 |
24 |
7 |
7542 |
216.3 |
-3.7 |
0.174 |
0 |
0 |
0 |
0.000 |
Average: |
217.7 |
-3.7 |
0.175 |
0 |
0 |
0 |
0.000 |
10 |
16 |
|
E |
24 |
9 |
7561 |
x |
E |
-x+1,-y+2,z-1/2 |
2_674 |
19 |
5 |
7561 |
175.6 |
-0.1 |
0.679 |
1 |
0 |
0 |
0.000 |
11 |
17 |
|
[MAN]E:201 |
11 |
1 |
288 |
◊ |
E |
x,y,z |
1_555 |
25 |
13 |
7561 |
170.8 |
3.1 |
0.462 |
3 |
0 |
0 |
0.000 |
18 |
|
[MAN]C:201 |
11 |
1 |
289 |
◊ |
C |
x,y,z |
1_555 |
24 |
13 |
7581 |
150.7 |
2.6 |
0.445 |
3 |
0 |
0 |
0.000 |
19 |
|
[MAN]D:201 |
11 |
1 |
287 |
◊ |
D |
x,y,z |
1_555 |
25 |
13 |
7552 |
150.4 |
2.6 |
0.458 |
3 |
0 |
0 |
0.000 |
20 |
|
[MAN]A:201 |
11 |
1 |
290 |
◊ |
A |
x,y,z |
1_555 |
24 |
13 |
7542 |
150.1 |
2.6 |
0.456 |
3 |
0 |
0 |
0.000 |
21 |
|
[MAN]B:201 |
11 |
1 |
290 |
◊ |
B |
x,y,z |
1_555 |
25 |
13 |
7618 |
149.3 |
2.6 |
0.424 |
3 |
0 |
0 |
0.000 |
Average: |
154.2 |
2.7 |
0.449 |
3 |
0 |
0 |
0.000 |
12 |
22 |
|
[MMA]E:202 |
11 |
1 |
325 |
◊ |
E |
x,y,z |
1_555 |
19 |
9 |
7561 |
137.6 |
2.2 |
0.295 |
0 |
0 |
0 |
0.000 |
23 |
|
[MMA]C:202 |
10 |
1 |
323 |
◊ |
C |
x,y,z |
1_555 |
20 |
9 |
7581 |
117.3 |
1.4 |
0.328 |
0 |
0 |
0 |
0.000 |
24 |
|
[MMA]A:202 |
11 |
1 |
324 |
◊ |
A |
x,y,z |
1_555 |
19 |
9 |
7542 |
116.6 |
1.5 |
0.291 |
0 |
0 |
0 |
0.000 |
25 |
|
[MMA]D:202 |
10 |
1 |
320 |
◊ |
D |
x,y,z |
1_555 |
19 |
9 |
7552 |
115.6 |
1.4 |
0.330 |
0 |
0 |
0 |
0.000 |
26 |
|
[MMA]B:202 |
10 |
1 |
320 |
◊ |
B |
x,y,z |
1_555 |
21 |
9 |
7618 |
115.0 |
1.4 |
0.323 |
0 |
0 |
0 |
0.000 |
Average: |
120.5 |
1.6 |
0.313 |
0 |
0 |
0 |
0.000 |
13 |
27 |
|
E |
17 |
8 |
7561 |
◊ |
D |
-y+2,x+1,z-1/4 |
3_764 |
18 |
8 |
7552 |
133.5 |
-1.3 |
0.466 |
0 |
0 |
0 |
0.000 |
14 |
28 |
|
E |
10 |
5 |
7561 |
◊ |
C |
x,y,z |
1_555 |
11 |
6 |
7581 |
101.6 |
1.8 |
0.895 |
0 |
0 |
0 |
0.000 |
15 |
29 |
|
[MMA]C:202 |
7 |
1 |
323 |
◊ |
D |
x,y,z |
1_555 |
10 |
5 |
7552 |
81.5 |
1.2 |
0.355 |
0 |
0 |
0 |
0.000 |
30 |
|
B |
10 |
5 |
7618 |
◊ |
[MMA]A:202 |
-y+1,x+1,z+3/4 |
3_665 |
7 |
1 |
324 |
80.8 |
1.2 |
0.354 |
0 |
0 |
0 |
0.000 |
31 |
|
[MMA]D:202 |
7 |
1 |
320 |
◊ |
C |
x,y,z |
1_555 |
10 |
5 |
7581 |
80.5 |
1.2 |
0.375 |
0 |
0 |
0 |
0.000 |
32 |
|
[MMA]B:202 |
8 |
1 |
320 |
◊ |
A |
-y+1,x+1,z+3/4 |
3_665 |
9 |
5 |
7542 |
79.2 |
1.3 |
0.308 |
0 |
0 |
0 |
0.000 |
Average: |
80.5 |
1.2 |
0.348 |
0 |
0 |
0 |
0.000 |
16 |
33 |
|
A |
10 |
5 |
7542 |
◊ |
E |
-x+1,-y+2,z-1/2 |
2_674 |
12 |
6 |
7561 |
74.1 |
0.3 |
0.509 |
0 |
0 |
0 |
0.000 |
17 |
34 |
|
[MMA]E:202 |
4 |
1 |
325 |
cf |
[MAN]E:201 |
x,y,z |
1_555 |
6 |
1 |
288 |
54.3 |
2.5 |
0.310 |
0 |
0 |
0 |
0.000 |
35 |
|
[MMA]C:202 |
4 |
1 |
323 |
cf |
[MAN]C:201 |
x,y,z |
1_555 |
6 |
1 |
289 |
42.4 |
1.9 |
0.287 |
0 |
0 |
0 |
0.000 |
36 |
|
[MMA]D:202 |
4 |
1 |
320 |
cf |
[MAN]D:201 |
x,y,z |
1_555 |
5 |
1 |
287 |
42.0 |
1.9 |
0.339 |
0 |
0 |
0 |
0.000 |
37 |
|
[MMA]A:202 |
4 |
1 |
324 |
cf |
[MAN]A:201 |
x,y,z |
1_555 |
6 |
1 |
290 |
41.9 |
1.9 |
0.310 |
0 |
0 |
0 |
0.000 |
38 |
|
[MMA]B:202 |
4 |
1 |
320 |
cf |
[MAN]B:201 |
x,y,z |
1_555 |
6 |
1 |
290 |
41.5 |
1.9 |
0.280 |
0 |
0 |
0 |
0.000 |
Average: |
44.4 |
2.0 |
0.305 |
0 |
0 |
0 |
0.000 |
18 |
39 |
|
[MMA]B:202 |
6 |
1 |
320 |
f |
[MMA]A:202 |
-y+1,x+1,z+3/4 |
3_665 |
7 |
1 |
324 |
52.6 |
1.0 |
0.091 |
1 |
0 |
0 |
0.000 |
19 |
40 |
|
[MMA]D:202 |
6 |
1 |
320 |
f |
[MMA]C:202 |
x,y,z |
1_555 |
6 |
1 |
323 |
51.9 |
1.0 |
0.129 |
1 |
0 |
0 |
0.000 |
20 |
41 |
|
D |
6 |
2 |
7552 |
◊ |
C |
-y+2,x+1,z-1/4 |
3_764 |
7 |
3 |
7581 |
41.3 |
0.7 |
0.807 |
0 |
0 |
0 |
0.000 |
42 |
|
A |
7 |
3 |
7542 |
◊ |
B |
-x,-y+2,z-1/2 |
2_574 |
7 |
3 |
7618 |
34.5 |
0.4 |
0.730 |
0 |
0 |
0 |
0.000 |
Average: |
37.9 |
0.5 |
0.768 |
0 |
0 |
0 |
0.000 |
21 |
43 |
|
[MAN]B:201 |
4 |
1 |
290 |
f |
[MMA]A:202 |
-y+1,x+1,z+3/4 |
3_665 |
5 |
1 |
324 |
31.5 |
1.5 |
0.252 |
0 |
0 |
0 |
0.000 |
44 |
|
[MMA]B:202 |
5 |
1 |
320 |
f |
[MAN]A:201 |
-y+1,x+1,z+3/4 |
3_665 |
4 |
1 |
290 |
30.2 |
1.5 |
0.228 |
0 |
0 |
0 |
0.000 |
45 |
|
[MMA]C:202 |
5 |
1 |
323 |
f |
[MAN]D:201 |
x,y,z |
1_555 |
4 |
1 |
287 |
28.8 |
1.4 |
0.214 |
0 |
0 |
0 |
0.000 |
46 |
|
[MMA]D:202 |
5 |
1 |
320 |
f |
[MAN]C:201 |
x,y,z |
1_555 |
4 |
1 |
289 |
28.7 |
1.4 |
0.241 |
0 |
0 |
0 |
0.000 |
Average: |
29.8 |
1.4 |
0.234 |
0 |
0 |
0 |
0.000 |
22 |
47 |
|
E |
2 |
2 |
7561 |
◊ |
D |
-y+2,x+1,z+3/4 |
3_765 |
6 |
2 |
7552 |
27.8 |
-0.0 |
0.637 |
0 |
0 |
0 |
0.000 |
23 |
48 |
|
[MAN]C:201 |
2 |
1 |
289 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
7552 |
12.2 |
0.1 |
0.267 |
0 |
0 |
0 |
0.000 |
49 |
|
[MAN]D:201 |
2 |
1 |
287 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
7581 |
11.8 |
0.2 |
0.270 |
0 |
0 |
0 |
0.000 |
50 |
|
[MAN]B:201 |
2 |
1 |
290 |
◊ |
A |
-y+1,x+1,z+3/4 |
3_665 |
2 |
1 |
7542 |
11.7 |
0.2 |
0.275 |
0 |
0 |
0 |
0.000 |
51 |
|
B |
2 |
1 |
7618 |
◊ |
[MAN]A:201 |
-y+1,x+1,z+3/4 |
3_665 |
2 |
1 |
290 |
11.0 |
0.1 |
0.276 |
0 |
0 |
0 |
0.000 |
Average: |
11.6 |
0.1 |
0.272 |
0 |
0 |
0 |
0.000 |
24 |
52 |
|
A |
4 |
2 |
7542 |
◊ |
C |
x,y,z-1 |
1_554 |
3 |
3 |
7581 |
10.8 |
-0.0 |
0.593 |
0 |
0 |
0 |
0.000 |
53 |
|
B |
2 |
2 |
7618 |
◊ |
D |
-y+2,x+1,z-1/4 |
3_764 |
4 |
2 |
7552 |
10.6 |
-0.0 |
0.554 |
0 |
0 |
0 |
0.000 |
Average: |
10.7 |
-0.0 |
0.574 |
0 |
0 |
0 |
0.000 |
25 |
54 |
|
[MAN]B:201 |
1 |
1 |
290 |
f |
[MAN]A:201 |
-y+1,x+1,z+3/4 |
3_665 |
1 |
1 |
290 |
3.3 |
0.2 |
0.182 |
0 |
0 |
0 |
0.000 |
55 |
|
[MAN]D:201 |
1 |
1 |
287 |
f |
[MAN]C:201 |
x,y,z |
1_555 |
1 |
1 |
289 |
2.1 |
0.1 |
0.182 |
0 |
0 |
0 |
0.000 |
Average: |
2.7 |
0.2 |
0.182 |
0 |
0 |
0 |
0.000 |
26 |
56 |
|
C |
1 |
1 |
7581 |
◊ |
D |
-y+2,x+1,z-1/4 |
3_764 |
1 |
1 |
7552 |
2.4 |
0.1 |
0.718 |
0 |
0 |
0 |
0.000 |
57 |
|
A |
1 |
1 |
7542 |
◊ |
B |
x,y,z-1 |
1_554 |
1 |
1 |
7618 |
1.3 |
0.0 |
0.677 |
0 |
0 |
0 |
0.000 |
Average: |
1.9 |
0.0 |
0.697 |
0 |
0 |
0 |
0.000 |
27 |
58 |
|
E |
1 |
1 |
7561 |
f |
[MMA]E:202 |
-x+1,-y+2,z-1/2 |
2_674 |
1 |
1 |
325 |
0.6 |
-0.0 |
0.349 |
0 |
0 |
0 |
0.000 |
|