| ## |
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 |
|
C |
88 |
27 |
11841 |
◊ |
A |
x,y,z |
1_555 |
90 |
27 |
11821 |
916.1 |
-13.9 |
0.041 |
2 |
0 |
0 |
0.270 |
2 |
|
D |
91 |
27 |
11875 |
◊ |
B |
x,y,z |
1_555 |
90 |
28 |
11915 |
914.0 |
-14.2 |
0.042 |
2 |
0 |
0 |
0.270 |
| Average: |
915.1 |
-14.0 |
0.042 |
2 |
0 |
0 |
0.270 |
| 2 |
3 |
|
D |
82 |
23 |
11875 |
◊ |
C |
x,y,z |
1_555 |
86 |
26 |
11841 |
825.0 |
-11.6 |
0.101 |
8 |
0 |
0 |
0.268 |
4 |
|
B |
79 |
23 |
11915 |
◊ |
A |
x,y,z |
1_555 |
82 |
23 |
11821 |
807.4 |
-12.0 |
0.069 |
8 |
0 |
0 |
0.268 |
| Average: |
816.2 |
-11.8 |
0.085 |
8 |
0 |
0 |
0.268 |
| 3 |
5 |
|
A |
39 |
11 |
11821 |
◊ |
D |
x-1,y,z-1 |
1_454 |
39 |
11 |
11875 |
346.2 |
-1.2 |
0.605 |
6 |
10 |
0 |
0.000 |
| 4 |
6 |
|
D |
37 |
13 |
11875 |
x |
D |
x-1,y,z |
1_455 |
36 |
10 |
11875 |
321.2 |
-2.8 |
0.416 |
0 |
0 |
0 |
0.000 |
7 |
|
C |
27 |
11 |
11841 |
x |
C |
x-1,y,z |
1_455 |
23 |
8 |
11841 |
247.0 |
-3.2 |
0.256 |
0 |
0 |
0 |
0.000 |
| Average: |
284.1 |
-3.0 |
0.336 |
0 |
0 |
0 |
0.000 |
| 5 |
8 |
|
C |
27 |
9 |
11841 |
◊ |
A |
x,y-1,z |
1_545 |
27 |
10 |
11821 |
191.7 |
1.4 |
0.825 |
2 |
0 |
0 |
0.000 |
| 6 |
9 |
|
[GOL]B:3006 |
6 |
1 |
221 |
f |
B |
x,y,z |
1_555 |
23 |
12 |
11915 |
123.9 |
-0.5 |
0.507 |
3 |
0 |
0 |
0.057 |
10 |
|
[GOL]A:3005 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
22 |
12 |
11821 |
123.4 |
-0.5 |
0.505 |
2 |
0 |
0 |
0.057 |
11 |
|
[GOL]D:3008 |
6 |
1 |
219 |
f |
D |
x,y,z |
1_555 |
20 |
11 |
11875 |
122.7 |
-0.5 |
0.558 |
2 |
0 |
0 |
0.057 |
| Average: |
123.3 |
-0.5 |
0.523 |
2 |
0 |
0 |
0.057 |
| 7 |
12 |
|
[GOL]C:3007 |
6 |
1 |
218 |
f |
C |
x,y,z |
1_555 |
19 |
12 |
11841 |
116.4 |
-0.6 |
0.503 |
3 |
0 |
0 |
0.033 |
| 8 |
13 |
|
[GOL]A:3001 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
24 |
14 |
11821 |
113.3 |
-0.5 |
0.520 |
6 |
0 |
0 |
0.129 |
14 |
|
[GOL]C:3003 |
6 |
1 |
219 |
f |
C |
x,y,z |
1_555 |
24 |
14 |
11841 |
112.7 |
-0.5 |
0.554 |
6 |
0 |
0 |
0.129 |
15 |
|
[GOL]D:3004 |
6 |
1 |
219 |
f |
D |
x,y,z |
1_555 |
24 |
14 |
11875 |
112.5 |
-0.5 |
0.555 |
7 |
0 |
0 |
0.129 |
16 |
|
[GOL]B:3002 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
23 |
14 |
11915 |
111.6 |
-0.5 |
0.548 |
7 |
0 |
0 |
0.129 |
| Average: |
112.5 |
-0.5 |
0.544 |
7 |
0 |
0 |
0.129 |
| 9 |
17 |
|
[GOL]A:3010 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
18 |
6 |
11821 |
112.6 |
-0.4 |
0.545 |
4 |
0 |
0 |
0.037 |
| 10 |
18 |
|
[GOL]D:3014 |
6 |
1 |
216 |
f |
D |
x,y,z |
1_555 |
17 |
6 |
11875 |
112.1 |
0.1 |
0.568 |
2 |
0 |
0 |
0.015 |
| 11 |
19 |
|
[GOL]D:3017 |
6 |
1 |
218 |
f |
D |
x,y,z |
1_555 |
17 |
6 |
11875 |
111.9 |
-0.4 |
0.543 |
4 |
0 |
0 |
0.085 |
20 |
|
[GOL]C:3012 |
6 |
1 |
220 |
f |
C |
x,y,z |
1_555 |
18 |
6 |
11841 |
105.3 |
-0.2 |
0.598 |
6 |
0 |
0 |
0.085 |
| Average: |
108.6 |
-0.3 |
0.570 |
5 |
0 |
0 |
0.085 |
| 12 |
21 |
|
[GOL]A:3015 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
11821 |
98.4 |
0.1 |
0.623 |
3 |
0 |
0 |
0.042 |
22 |
|
[GOL]B:3011 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
17 |
5 |
11915 |
98.4 |
0.1 |
0.624 |
3 |
0 |
0 |
0.042 |
23 |
|
[GOL]C:3016 |
6 |
1 |
219 |
f |
C |
x,y,z |
1_555 |
15 |
5 |
11841 |
98.3 |
0.2 |
0.634 |
3 |
0 |
0 |
0.042 |
| Average: |
98.4 |
0.1 |
0.627 |
3 |
0 |
0 |
0.042 |
| 13 |
24 |
|
B |
9 |
3 |
11915 |
◊ |
D |
x-1,y+1,z |
1_465 |
6 |
3 |
11875 |
72.9 |
-0.9 |
0.371 |
0 |
0 |
0 |
0.000 |
| 14 |
25 |
|
C |
7 |
2 |
11841 |
◊ |
B |
x-1,y-1,z-1 |
1_444 |
12 |
4 |
11915 |
64.9 |
0.1 |
0.657 |
0 |
0 |
0 |
0.000 |
| 15 |
26 |
|
[GOL]A:3009 |
4 |
1 |
221 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
11821 |
63.9 |
-0.1 |
0.541 |
0 |
0 |
0 |
0.003 |
| 16 |
27 |
|
[GOL]C:3012 |
4 |
1 |
220 |
◊ |
D |
x,y,z |
1_555 |
6 |
3 |
11875 |
47.8 |
0.7 |
0.762 |
1 |
0 |
0 |
0.000 |
28 |
|
[GOL]D:3017 |
4 |
1 |
218 |
◊ |
C |
x,y,z |
1_555 |
6 |
3 |
11841 |
26.0 |
0.3 |
0.656 |
0 |
0 |
0 |
0.000 |
| Average: |
36.9 |
0.5 |
0.709 |
1 |
0 |
0 |
0.000 |
| 17 |
29 |
|
[GOL]A:3015 |
4 |
1 |
219 |
f |
[GOL]A:3009 |
x,y,z |
1_555 |
4 |
1 |
221 |
45.0 |
0.2 |
0.556 |
2 |
0 |
0 |
0.011 |
| 18 |
30 |
|
[GOL]C:3007 |
4 |
1 |
218 |
f |
[GOL]C:3003 |
x,y,z |
1_555 |
3 |
1 |
219 |
37.4 |
0.6 |
0.696 |
2 |
0 |
0 |
0.005 |
| 19 |
31 |
|
[GOL]B:3006 |
5 |
1 |
221 |
f |
[GOL]B:3002 |
x,y,z |
1_555 |
4 |
1 |
220 |
37.3 |
0.2 |
0.582 |
1 |
0 |
0 |
0.004 |
| 20 |
32 |
|
[GOL]D:3008 |
5 |
1 |
219 |
f |
[GOL]D:3004 |
x,y,z |
1_555 |
4 |
1 |
219 |
36.9 |
0.1 |
0.590 |
1 |
0 |
0 |
0.006 |
33 |
|
[GOL]A:3005 |
5 |
1 |
218 |
f |
[GOL]A:3001 |
x,y,z |
1_555 |
4 |
1 |
219 |
36.3 |
0.1 |
0.627 |
1 |
0 |
0 |
0.006 |
| Average: |
36.6 |
0.1 |
0.609 |
1 |
0 |
0 |
0.006 |
| 21 |
34 |
|
[GOL]B:3011 |
2 |
1 |
219 |
◊ |
[GOL]A:3010 |
x,y,z |
1_555 |
4 |
1 |
218 |
36.6 |
-0.7 |
0.326 |
0 |
0 |
0 |
0.013 |
| 22 |
35 |
|
[GOL]A:3015 |
2 |
1 |
219 |
◊ |
B |
x,y,z |
1_555 |
5 |
1 |
11915 |
36.6 |
0.1 |
0.461 |
1 |
0 |
0 |
0.013 |
36 |
|
[GOL]C:3016 |
2 |
1 |
219 |
◊ |
D |
x,y,z |
1_555 |
5 |
1 |
11875 |
36.2 |
0.1 |
0.466 |
1 |
0 |
0 |
0.013 |
37 |
|
[GOL]B:3011 |
2 |
1 |
219 |
◊ |
A |
x,y,z |
1_555 |
5 |
1 |
11821 |
36.1 |
0.1 |
0.464 |
1 |
0 |
0 |
0.013 |
| Average: |
36.3 |
0.1 |
0.463 |
1 |
0 |
0 |
0.013 |
| 23 |
38 |
|
[GOL]D:3017 |
3 |
1 |
218 |
◊ |
[GOL]C:3016 |
x,y,z |
1_555 |
2 |
1 |
219 |
36.5 |
-0.8 |
0.319 |
0 |
0 |
0 |
0.013 |
| 24 |
39 |
|
[GOL]D:3014 |
2 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
5 |
1 |
11841 |
35.9 |
0.0 |
0.462 |
1 |
0 |
0 |
0.007 |
| 25 |
40 |
|
[CA]B:2002 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
11915 |
35.5 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.349 |
41 |
|
[CA]D:2004 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
11 |
7 |
11875 |
35.5 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.349 |
42 |
|
[CA]C:2003 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
11 |
7 |
11841 |
35.4 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.349 |
43 |
|
[CA]A:2001 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
11821 |
35.0 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.349 |
| Average: |
35.3 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.349 |
| 26 |
44 |
|
[GOL]A:3009 |
3 |
1 |
221 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
11915 |
34.0 |
0.0 |
0.572 |
0 |
0 |
0 |
0.000 |
| 27 |
45 |
|
[GOL]D:3014 |
4 |
1 |
216 |
◊ |
[GOL]C:3012 |
x,y,z |
1_555 |
4 |
1 |
220 |
33.6 |
-0.3 |
0.519 |
0 |
0 |
0 |
0.005 |
| 28 |
46 |
|
D |
3 |
2 |
11875 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
11821 |
27.2 |
0.6 |
0.845 |
0 |
0 |
0 |
0.000 |
47 |
|
C |
3 |
2 |
11841 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
11915 |
26.9 |
0.6 |
0.841 |
0 |
0 |
0 |
0.000 |
| Average: |
27.1 |
0.6 |
0.843 |
0 |
0 |
0 |
0.000 |
| 29 |
48 |
|
[GOL]A:3010 |
4 |
1 |
218 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
11915 |
23.5 |
0.3 |
0.673 |
0 |
0 |
0 |
0.000 |
| 30 |
49 |
|
[GOL]C:3003 |
3 |
1 |
219 |
f |
[CA]C:2003 |
x,y,z |
1_555 |
1 |
1 |
85 |
19.7 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.107 |
50 |
|
[GOL]A:3001 |
3 |
1 |
219 |
f |
[CA]A:2001 |
x,y,z |
1_555 |
1 |
1 |
85 |
19.7 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.107 |
51 |
|
[GOL]B:3002 |
3 |
1 |
220 |
f |
[CA]B:2002 |
x,y,z |
1_555 |
1 |
1 |
85 |
19.5 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.107 |
52 |
|
[GOL]D:3004 |
3 |
1 |
219 |
f |
[CA]D:2004 |
x,y,z |
1_555 |
1 |
1 |
85 |
19.2 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.107 |
| Average: |
19.5 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.107 |
| 31 |
53 |
|
[GOL]C:3016 |
1 |
1 |
219 |
◊ |
D |
x-1,y,z |
1_455 |
4 |
1 |
11875 |
18.0 |
0.0 |
0.475 |
0 |
0 |
0 |
0.000 |
| 32 |
54 |
|
B |
3 |
1 |
11915 |
x |
B |
x-1,y,z |
1_455 |
3 |
2 |
11915 |
17.9 |
0.7 |
0.853 |
1 |
1 |
0 |
0.000 |
| 33 |
55 |
|
D |
2 |
2 |
11875 |
◊ |
B |
x,y-1,z |
1_545 |
5 |
2 |
11915 |
13.5 |
0.1 |
0.689 |
0 |
0 |
0 |
0.000 |
| 34 |
56 |
|
C |
1 |
1 |
11841 |
◊ |
B |
x,y-1,z-1 |
1_544 |
1 |
1 |
11915 |
6.9 |
0.2 |
0.830 |
0 |
0 |
0 |
0.000 |
| 35 |
57 |
|
[GOL]C:3007 |
1 |
1 |
218 |
f |
[CA]C:2003 |
x,y,z |
1_555 |
1 |
1 |
85 |
0.5 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| 36 |
58 |
|
C |
1 |
1 |
11841 |
◊ |
D |
x-1,y,z |
1_455 |
1 |
1 |
11875 |
0.1 |
0.0 |
0.642 |
0 |
0 |
0 |
0.000 |
|