## |
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 |
|
D |
53 |
10 |
2601 |
◊ |
C |
x,y,z |
1_555 |
55 |
10 |
2606 |
477.9 |
2.7 |
0.696 |
24 |
0 |
0 |
0.000 |
2 |
2 |
|
A |
43 |
11 |
7225 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
41 |
12 |
7225 |
368.0 |
-2.6 |
0.303 |
5 |
0 |
0 |
0.000 |
3 |
3 |
|
B |
43 |
11 |
7308 |
x |
B |
-x,y-1/2,-z-1/2 |
3_544 |
35 |
9 |
7308 |
354.7 |
-1.6 |
0.430 |
7 |
1 |
0 |
0.000 |
4 |
4 |
|
E |
39 |
5 |
1492 |
◊ |
B |
x,y,z |
1_555 |
38 |
11 |
7308 |
353.1 |
-4.4 |
0.335 |
11 |
0 |
0 |
0.551 |
5 |
5 |
|
C |
38 |
5 |
2606 |
◊ |
A |
x,y,z |
1_555 |
36 |
11 |
7225 |
346.9 |
-5.0 |
0.339 |
10 |
0 |
0 |
0.069 |
6 |
6 |
|
B |
36 |
11 |
7308 |
◊ |
A |
x,y,z |
1_555 |
39 |
13 |
7225 |
345.1 |
-1.1 |
0.441 |
5 |
1 |
0 |
0.000 |
7 |
7 |
|
F |
30 |
5 |
2017 |
◊ |
E |
x,y,z |
1_555 |
29 |
6 |
1492 |
256.8 |
1.5 |
0.629 |
12 |
0 |
0 |
0.000 |
8 |
8 |
|
B |
30 |
9 |
7308 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
26 |
8 |
7225 |
248.2 |
1.8 |
0.755 |
2 |
0 |
0 |
0.000 |
9 |
9 |
|
[UCL]C:7 |
16 |
1 |
472 |
cf |
C |
x,y,z |
1_555 |
13 |
1 |
2606 |
130.3 |
0.5 |
0.770 |
1 |
0 |
0 |
0.000 |
10 |
10 |
|
[UCL]E:7 |
16 |
1 |
471 |
cf |
E |
x,y,z |
1_555 |
13 |
1 |
1492 |
127.6 |
0.9 |
0.756 |
1 |
0 |
0 |
0.000 |
11 |
11 |
|
[UCL]F:19 |
15 |
1 |
449 |
cf |
F |
x,y,z |
1_555 |
15 |
1 |
2017 |
125.6 |
1.0 |
0.740 |
1 |
0 |
0 |
0.000 |
12 |
12 |
|
[UCL]D:19 |
15 |
1 |
457 |
cf |
D |
x,y,z |
1_555 |
14 |
1 |
2601 |
125.0 |
1.3 |
0.781 |
1 |
0 |
0 |
0.000 |
13 |
13 |
|
[UCL]D:20 |
15 |
1 |
459 |
cf |
[UCL]D:19 |
x,y,z |
1_555 |
12 |
1 |
457 |
119.2 |
-0.4 |
0.764 |
0 |
0 |
0 |
0.044 |
14 |
|
[UCL]E:8 |
14 |
1 |
462 |
cf |
[UCL]E:7 |
x,y,z |
1_555 |
13 |
1 |
471 |
115.9 |
-0.7 |
0.726 |
0 |
0 |
0 |
0.044 |
Average: |
117.6 |
-0.6 |
0.745 |
0 |
0 |
0 |
0.044 |
14 |
15 |
|
[UCL]F:20 |
15 |
1 |
460 |
cf |
[UCL]F:19 |
x,y,z |
1_555 |
13 |
1 |
449 |
118.1 |
-0.7 |
0.750 |
0 |
0 |
0 |
0.000 |
16 |
|
[UCL]C:8 |
15 |
1 |
455 |
cf |
[UCL]C:7 |
x,y,z |
1_555 |
13 |
1 |
472 |
117.6 |
-0.0 |
0.773 |
0 |
0 |
0 |
0.000 |
Average: |
117.9 |
-0.4 |
0.762 |
0 |
0 |
0 |
0.000 |
15 |
17 |
|
[UCL]D:20 |
14 |
1 |
459 |
cf |
D |
x,y,z |
1_555 |
11 |
1 |
2601 |
112.8 |
2.7 |
0.797 |
0 |
0 |
0 |
0.000 |
16 |
18 |
|
[UCL]F:20 |
12 |
1 |
460 |
cf |
F |
x,y,z |
1_555 |
13 |
1 |
2017 |
109.3 |
2.7 |
0.802 |
0 |
0 |
0 |
0.000 |
17 |
19 |
|
[UCL]C:8 |
12 |
1 |
455 |
cf |
C |
x,y,z |
1_555 |
13 |
1 |
2606 |
109.2 |
2.8 |
0.795 |
0 |
0 |
0 |
0.000 |
18 |
20 |
|
E |
11 |
1 |
1492 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
15 |
5 |
7225 |
102.4 |
1.5 |
0.568 |
0 |
0 |
0 |
0.000 |
19 |
21 |
|
C |
13 |
1 |
2606 |
◊ |
B |
x,y,z |
1_555 |
11 |
6 |
7308 |
98.0 |
0.7 |
0.233 |
0 |
0 |
0 |
0.000 |
20 |
22 |
|
D |
16 |
2 |
2601 |
◊ |
B |
x,y,z |
1_555 |
14 |
4 |
7308 |
96.4 |
1.3 |
0.672 |
0 |
0 |
0 |
0.000 |
21 |
23 |
|
[GOL]D:101 |
5 |
1 |
220 |
f |
D |
x,y,z |
1_555 |
15 |
3 |
2601 |
90.0 |
-0.5 |
0.398 |
1 |
0 |
0 |
0.000 |
22 |
24 |
|
[EDO]F:101 |
4 |
1 |
182 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
13 |
4 |
7225 |
89.7 |
2.4 |
0.254 |
2 |
0 |
0 |
0.000 |
23 |
25 |
|
C |
14 |
1 |
2606 |
◊ |
A |
x,y-1,z |
1_545 |
11 |
2 |
7225 |
89.1 |
0.1 |
0.504 |
0 |
0 |
0 |
0.000 |
24 |
26 |
|
[GOL]B:201 |
5 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
18 |
8 |
7308 |
83.1 |
-0.2 |
0.546 |
3 |
0 |
0 |
0.100 |
25 |
27 |
|
[UCL]E:8 |
8 |
1 |
462 |
◊ |
F |
x,y,z |
1_555 |
11 |
3 |
2017 |
81.5 |
0.8 |
0.638 |
1 |
0 |
0 |
0.000 |
26 |
28 |
|
D |
12 |
1 |
2601 |
◊ |
A |
x,y-1,z |
1_545 |
8 |
2 |
7225 |
76.2 |
1.3 |
0.415 |
0 |
0 |
0 |
0.000 |
27 |
29 |
|
[UCL]C:8 |
7 |
1 |
455 |
◊ |
D |
x,y,z |
1_555 |
8 |
3 |
2601 |
75.5 |
0.9 |
0.638 |
1 |
0 |
0 |
0.000 |
28 |
30 |
|
[UCL]D:20 |
9 |
1 |
459 |
◊ |
C |
x,y,z |
1_555 |
9 |
4 |
2606 |
74.6 |
0.9 |
0.676 |
1 |
0 |
0 |
0.000 |
29 |
31 |
|
[UCL]F:20 |
7 |
1 |
460 |
◊ |
E |
x,y,z |
1_555 |
9 |
4 |
1492 |
68.7 |
0.8 |
0.643 |
1 |
0 |
0 |
0.000 |
30 |
32 |
|
[GOL]B:201 |
5 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
7225 |
64.5 |
-0.6 |
0.467 |
1 |
0 |
0 |
0.000 |
31 |
33 |
|
[UCL]D:19 |
6 |
1 |
457 |
◊ |
C |
x,y,z |
1_555 |
6 |
3 |
2606 |
60.6 |
0.9 |
0.678 |
2 |
0 |
0 |
0.000 |
32 |
34 |
|
[UCL]C:7 |
5 |
1 |
472 |
◊ |
D |
x,y,z |
1_555 |
6 |
2 |
2601 |
60.1 |
1.0 |
0.668 |
2 |
0 |
0 |
0.000 |
33 |
35 |
|
[EDO]E:101 |
4 |
1 |
182 |
f |
E |
x,y,z |
1_555 |
6 |
3 |
1492 |
59.6 |
1.7 |
0.712 |
2 |
0 |
0 |
0.000 |
34 |
36 |
|
[GOL]D:101 |
6 |
1 |
220 |
◊ |
C |
x,y,z |
1_555 |
10 |
3 |
2606 |
58.7 |
0.1 |
0.563 |
1 |
0 |
0 |
0.000 |
35 |
37 |
|
[UCL]E:7 |
5 |
1 |
471 |
◊ |
F |
x,y,z |
1_555 |
5 |
2 |
2017 |
57.4 |
1.0 |
0.659 |
2 |
0 |
0 |
0.000 |
36 |
38 |
|
F |
6 |
2 |
2017 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
5 |
3 |
7225 |
57.2 |
-0.6 |
0.495 |
0 |
0 |
0 |
0.000 |
37 |
39 |
|
[EDO]E:101 |
4 |
1 |
182 |
◊ |
F |
x,y,z |
1_555 |
5 |
3 |
2017 |
56.9 |
1.1 |
0.648 |
1 |
0 |
0 |
0.000 |
38 |
40 |
|
F |
6 |
1 |
2017 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
7308 |
56.6 |
0.6 |
0.631 |
1 |
0 |
0 |
0.000 |
39 |
41 |
|
[MG]A:201 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
7225 |
50.3 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.100 |
40 |
42 |
|
[UCL]F:19 |
5 |
1 |
449 |
◊ |
E |
x,y,z |
1_555 |
5 |
2 |
1492 |
50.2 |
0.7 |
0.630 |
2 |
0 |
0 |
0.000 |
41 |
43 |
|
D |
7 |
1 |
2601 |
◊ |
A |
x,y,z |
1_555 |
7 |
4 |
7225 |
49.8 |
1.0 |
0.685 |
0 |
0 |
0 |
0.000 |
42 |
44 |
|
[EDO]F:101 |
4 |
1 |
182 |
f |
F |
x,y,z |
1_555 |
7 |
2 |
2017 |
46.5 |
0.6 |
0.643 |
1 |
0 |
0 |
0.000 |
43 |
45 |
|
[MG]E:102 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
5 |
2 |
1492 |
40.9 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.359 |
44 |
46 |
|
[EDO]E:101 |
4 |
1 |
182 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
8 |
2 |
7225 |
40.7 |
1.4 |
0.750 |
0 |
0 |
0 |
0.000 |
45 |
47 |
|
[GOL]D:101 |
2 |
1 |
220 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
7225 |
40.1 |
0.7 |
0.719 |
1 |
0 |
0 |
0.000 |
46 |
48 |
|
[UCL]D:20 |
6 |
1 |
459 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
7308 |
31.9 |
-0.7 |
0.615 |
0 |
0 |
0 |
0.000 |
47 |
49 |
|
[GOL]B:201 |
3 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
5 |
1 |
2606 |
31.3 |
0.3 |
0.548 |
0 |
0 |
0 |
0.000 |
48 |
50 |
|
[UCL]D:19 |
3 |
1 |
457 |
◊ |
[UCL]C:7 |
x,y,z |
1_555 |
3 |
1 |
472 |
26.2 |
0.7 |
0.626 |
0 |
0 |
0 |
0.000 |
51 |
|
[UCL]F:19 |
3 |
1 |
449 |
◊ |
[UCL]E:7 |
x,y,z |
1_555 |
3 |
1 |
471 |
20.2 |
0.5 |
0.612 |
0 |
0 |
0 |
0.000 |
Average: |
23.2 |
0.6 |
0.619 |
0 |
0 |
0 |
0.000 |
49 |
52 |
|
[EDO]F:101 |
2 |
1 |
182 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
1492 |
19.3 |
0.9 |
0.866 |
0 |
0 |
0 |
0.000 |
50 |
53 |
|
B |
3 |
2 |
7308 |
◊ |
D |
-x+1/2,-y,z-1/2 |
2_554 |
1 |
1 |
2601 |
12.6 |
-0.9 |
0.246 |
0 |
0 |
0 |
0.000 |
51 |
54 |
|
[MG]E:102 |
1 |
1 |
98 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
2 |
1 |
7225 |
6.1 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
52 |
55 |
|
[EDO]E:101 |
1 |
1 |
182 |
f |
[MG]E:102 |
x,y,z |
1_555 |
1 |
1 |
98 |
6.1 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.032 |
53 |
56 |
|
[MG]A:201 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
7308 |
4.7 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
54 |
57 |
|
[UCL]D:19 |
2 |
1 |
457 |
◊ |
[UCL]C:8 |
x,y,z |
1_555 |
3 |
1 |
455 |
4.2 |
0.1 |
0.524 |
0 |
0 |
0 |
0.000 |
58 |
|
[UCL]F:20 |
1 |
1 |
460 |
◊ |
[UCL]E:7 |
x,y,z |
1_555 |
1 |
1 |
471 |
1.9 |
-0.0 |
0.400 |
0 |
0 |
0 |
0.000 |
59 |
|
[UCL]D:20 |
3 |
1 |
459 |
◊ |
[UCL]C:7 |
x,y,z |
1_555 |
2 |
1 |
472 |
1.1 |
0.0 |
0.525 |
0 |
0 |
0 |
0.000 |
Average: |
2.4 |
0.0 |
0.483 |
0 |
0 |
0 |
0.000 |
55 |
60 |
|
[UCL]D:20 |
2 |
1 |
459 |
◊ |
[UCL]C:8 |
x,y,z |
1_555 |
2 |
1 |
455 |
3.8 |
0.2 |
0.492 |
0 |
0 |
0 |
0.000 |
56 |
61 |
|
[MG]A:201 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
2601 |
2.9 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.000 |
57 |
62 |
|
[UCL]F:19 |
1 |
1 |
449 |
◊ |
C |
-x+1/2,-y,z-1/2 |
2_554 |
1 |
1 |
2606 |
1.6 |
-0.2 |
0.307 |
0 |
0 |
0 |
0.000 |
|