| ## |
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 |
231 |
65 |
16641 |
◊ |
F |
x,y,z |
1_555 |
228 |
63 |
17085 |
2385.6 |
-26.2 |
0.011 |
27 |
8 |
0 |
0.866 |
2 |
|
E |
232 |
61 |
17019 |
◊ |
C |
x,y,z |
1_555 |
226 |
63 |
16922 |
2352.2 |
-24.9 |
0.018 |
32 |
8 |
0 |
0.866 |
3 |
|
G |
235 |
64 |
16837 |
◊ |
D |
x,y,z |
1_555 |
232 |
64 |
17118 |
2338.4 |
-25.6 |
0.013 |
28 |
5 |
0 |
0.866 |
4 |
|
I |
224 |
57 |
16803 |
◊ |
A |
x,y,z |
1_555 |
226 |
62 |
16909 |
2319.7 |
-22.4 |
0.024 |
36 |
9 |
0 |
0.866 |
5 |
|
K |
222 |
58 |
16710 |
◊ |
B |
x,y,z |
1_555 |
218 |
60 |
17028 |
2279.4 |
-26.5 |
0.009 |
34 |
7 |
0 |
0.866 |
6 |
|
L |
220 |
60 |
16917 |
◊ |
H |
x,y,z |
1_555 |
215 |
60 |
17127 |
2250.6 |
-29.2 |
0.002 |
28 |
6 |
0 |
0.866 |
| Average: |
2321.0 |
-25.8 |
0.013 |
31 |
7 |
0 |
0.866 |
| 2 |
7 |
|
E |
92 |
28 |
17019 |
◊ |
D |
x,y,z |
1_555 |
92 |
25 |
17118 |
772.4 |
2.5 |
0.752 |
11 |
2 |
0 |
0.000 |
8 |
|
C |
84 |
24 |
16922 |
◊ |
L |
x,y-1,z |
1_545 |
77 |
26 |
16917 |
682.1 |
-3.8 |
0.368 |
6 |
2 |
0 |
0.000 |
9 |
|
I |
82 |
24 |
16803 |
◊ |
F |
x,y,z |
1_555 |
87 |
25 |
17085 |
673.3 |
0.4 |
0.630 |
5 |
1 |
0 |
0.000 |
10 |
|
B |
78 |
22 |
17028 |
◊ |
A |
x,y,z |
1_555 |
77 |
23 |
16909 |
670.6 |
-2.3 |
0.483 |
5 |
3 |
0 |
0.000 |
| Average: |
699.6 |
-0.8 |
0.558 |
7 |
2 |
0 |
0.000 |
| 3 |
11 |
|
H |
69 |
15 |
17127 |
◊ |
K |
x,y,z-1 |
1_554 |
67 |
14 |
16710 |
623.2 |
-2.6 |
0.451 |
7 |
4 |
0 |
0.000 |
| 4 |
12 |
|
F |
49 |
13 |
17085 |
◊ |
C |
x,y,z |
1_555 |
43 |
13 |
16922 |
363.0 |
0.4 |
0.675 |
5 |
3 |
0 |
0.000 |
13 |
|
D |
47 |
13 |
17118 |
◊ |
A |
x,y,z |
1_555 |
45 |
15 |
16909 |
347.4 |
1.7 |
0.742 |
4 |
3 |
0 |
0.000 |
| Average: |
355.2 |
1.1 |
0.709 |
5 |
3 |
0 |
0.000 |
| 5 |
14 |
|
K |
50 |
13 |
16710 |
◊ |
G |
x,y,z |
1_555 |
35 |
10 |
16837 |
346.2 |
3.2 |
0.839 |
3 |
0 |
0 |
0.000 |
15 |
|
J |
18 |
4 |
16641 |
◊ |
H |
x,y-1,z |
1_545 |
24 |
8 |
17127 |
177.7 |
0.5 |
0.497 |
0 |
0 |
0 |
0.000 |
| Average: |
261.9 |
1.9 |
0.668 |
2 |
0 |
0 |
0.000 |
| 6 |
16 |
|
[PLP]F:401 |
15 |
1 |
389 |
cf |
F |
x,y,z |
1_555 |
39 |
16 |
17085 |
259.9 |
-0.6 |
0.493 |
3 |
0 |
0 |
0.118 |
17 |
|
[PLP]A:401 |
15 |
1 |
389 |
cf |
A |
x,y,z |
1_555 |
39 |
17 |
16909 |
255.8 |
-0.5 |
0.451 |
3 |
0 |
0 |
0.118 |
18 |
|
[PLP]I:401 |
15 |
1 |
388 |
cf |
I |
x,y,z |
1_555 |
40 |
16 |
16803 |
254.7 |
-1.3 |
0.322 |
4 |
0 |
0 |
0.118 |
19 |
|
[PLP]H:401 |
15 |
1 |
389 |
cf |
H |
x,y,z |
1_555 |
38 |
16 |
17127 |
253.4 |
-1.3 |
0.380 |
4 |
0 |
0 |
0.118 |
20 |
|
[PLP]K:401 |
15 |
1 |
388 |
cf |
K |
x,y,z |
1_555 |
37 |
16 |
16710 |
251.4 |
-0.8 |
0.407 |
4 |
0 |
0 |
0.118 |
21 |
|
[PLP]G:401 |
15 |
1 |
390 |
cf |
G |
x,y,z |
1_555 |
41 |
17 |
16837 |
250.1 |
-0.8 |
0.444 |
4 |
0 |
0 |
0.118 |
22 |
|
[PLP]C:401 |
15 |
1 |
387 |
cf |
C |
x,y,z |
1_555 |
38 |
16 |
16922 |
249.8 |
-0.3 |
0.503 |
3 |
0 |
0 |
0.118 |
23 |
|
[PLP]L:401 |
15 |
1 |
387 |
cf |
L |
x,y,z |
1_555 |
40 |
18 |
16917 |
249.1 |
-1.6 |
0.298 |
3 |
0 |
0 |
0.118 |
24 |
|
[PLP]J:401 |
15 |
1 |
386 |
cf |
J |
x,y,z |
1_555 |
37 |
16 |
16641 |
248.5 |
-0.9 |
0.352 |
5 |
0 |
0 |
0.118 |
25 |
|
[PLP]D:401 |
15 |
1 |
389 |
cf |
D |
x,y,z |
1_555 |
35 |
15 |
17118 |
248.2 |
-0.2 |
0.519 |
4 |
0 |
0 |
0.118 |
26 |
|
[PLP]B:401 |
15 |
1 |
389 |
cf |
B |
x,y,z |
1_555 |
37 |
15 |
17028 |
246.3 |
-1.1 |
0.402 |
4 |
0 |
0 |
0.118 |
27 |
|
[PLP]E:401 |
15 |
1 |
388 |
cf |
E |
x,y,z |
1_555 |
35 |
15 |
17019 |
244.1 |
-0.8 |
0.429 |
4 |
0 |
0 |
0.118 |
| Average: |
250.9 |
-0.8 |
0.417 |
4 |
0 |
0 |
0.118 |
| 7 |
28 |
|
D |
27 |
10 |
17118 |
◊ |
K |
x,y-1,z |
1_545 |
30 |
9 |
16710 |
251.6 |
0.2 |
0.494 |
0 |
0 |
0 |
0.000 |
29 |
|
H |
32 |
9 |
17127 |
◊ |
F |
x,y,z |
1_555 |
26 |
10 |
17085 |
237.4 |
-2.1 |
0.350 |
0 |
0 |
0 |
0.000 |
| Average: |
244.5 |
-0.9 |
0.422 |
0 |
0 |
0 |
0.000 |
| 8 |
30 |
|
B |
25 |
6 |
17028 |
x |
B |
x-1,y,z |
1_455 |
29 |
9 |
17028 |
245.0 |
-1.2 |
0.480 |
2 |
0 |
0 |
0.000 |
| 9 |
31 |
|
E |
25 |
6 |
17019 |
◊ |
K |
x,y-1,z |
1_545 |
32 |
9 |
16710 |
242.7 |
0.1 |
0.611 |
1 |
3 |
0 |
0.000 |
32 |
|
I |
27 |
7 |
16803 |
◊ |
H |
x,y,z |
1_555 |
21 |
5 |
17127 |
189.8 |
-0.3 |
0.566 |
1 |
0 |
0 |
0.000 |
| Average: |
216.3 |
-0.1 |
0.588 |
1 |
2 |
0 |
0.000 |
| 10 |
33 |
|
J |
22 |
9 |
16641 |
◊ |
D |
x,y,z-1 |
1_554 |
29 |
7 |
17118 |
213.3 |
1.2 |
0.692 |
1 |
2 |
0 |
0.000 |
34 |
|
F |
27 |
6 |
17085 |
◊ |
G |
x,y,z-1 |
1_554 |
25 |
11 |
16837 |
208.7 |
0.1 |
0.565 |
1 |
0 |
0 |
0.000 |
| Average: |
211.0 |
0.7 |
0.628 |
1 |
1 |
0 |
0.000 |
| 11 |
35 |
|
H |
25 |
7 |
17127 |
◊ |
J |
x-1,y+1,z |
1_465 |
23 |
6 |
16641 |
210.8 |
-1.8 |
0.343 |
0 |
0 |
0 |
0.000 |
| 12 |
36 |
|
I |
30 |
8 |
16803 |
◊ |
E |
x,y,z |
1_555 |
24 |
7 |
17019 |
197.2 |
-1.6 |
0.397 |
1 |
3 |
0 |
0.000 |
| 13 |
37 |
|
C |
28 |
9 |
16922 |
◊ |
E |
x-1,y,z |
1_455 |
20 |
8 |
17019 |
195.4 |
0.5 |
0.639 |
2 |
0 |
0 |
0.000 |
| 14 |
38 |
|
C |
20 |
6 |
16922 |
x |
C |
x-1,y,z |
1_455 |
21 |
6 |
16922 |
177.7 |
-0.2 |
0.565 |
0 |
0 |
0 |
0.000 |
| 15 |
39 |
|
C |
21 |
4 |
16922 |
◊ |
I |
x-1,y,z |
1_455 |
22 |
7 |
16803 |
155.4 |
-0.5 |
0.539 |
2 |
0 |
0 |
0.000 |
| 16 |
40 |
|
K |
18 |
4 |
16710 |
◊ |
G |
x-1,y,z |
1_455 |
18 |
4 |
16837 |
148.1 |
-1.1 |
0.424 |
2 |
0 |
0 |
0.000 |
| 17 |
41 |
|
H |
18 |
4 |
17127 |
◊ |
G |
x,y,z-1 |
1_554 |
14 |
4 |
16837 |
143.3 |
0.5 |
0.683 |
1 |
1 |
0 |
0.000 |
42 |
|
J |
16 |
5 |
16641 |
◊ |
K |
x,y-1,z-1 |
1_544 |
15 |
5 |
16710 |
127.5 |
-0.6 |
0.437 |
1 |
2 |
0 |
0.000 |
| Average: |
135.4 |
-0.1 |
0.560 |
1 |
2 |
0 |
0.000 |
| 18 |
43 |
|
A |
18 |
7 |
16909 |
x |
A |
x-1,y,z |
1_455 |
20 |
8 |
16909 |
143.1 |
0.9 |
0.645 |
1 |
0 |
0 |
0.000 |
| 19 |
44 |
|
D |
16 |
5 |
17118 |
◊ |
G |
x-1,y,z |
1_455 |
11 |
2 |
16837 |
129.9 |
0.7 |
0.652 |
2 |
0 |
0 |
0.000 |
| 20 |
45 |
|
J |
17 |
8 |
16641 |
x |
J |
x-1,y,z |
1_455 |
16 |
6 |
16641 |
115.6 |
1.9 |
0.792 |
1 |
4 |
0 |
0.000 |
| 21 |
46 |
|
L |
14 |
3 |
16917 |
x |
L |
x-1,y,z |
1_455 |
16 |
6 |
16917 |
106.0 |
-0.6 |
0.467 |
0 |
0 |
0 |
0.000 |
| 22 |
47 |
|
L |
16 |
5 |
16917 |
◊ |
C |
x-1,y+1,z |
1_465 |
12 |
5 |
16922 |
99.8 |
1.5 |
0.754 |
1 |
0 |
0 |
0.000 |
| 23 |
48 |
|
L |
11 |
3 |
16917 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
17028 |
94.8 |
2.2 |
0.894 |
0 |
0 |
0 |
0.000 |
| 24 |
49 |
|
E |
12 |
2 |
17019 |
◊ |
B |
x,y-1,z |
1_545 |
12 |
4 |
17028 |
93.7 |
-0.9 |
0.359 |
0 |
0 |
0 |
0.000 |
50 |
|
L |
8 |
3 |
16917 |
◊ |
I |
x,y,z |
1_555 |
10 |
3 |
16803 |
90.4 |
-1.6 |
0.188 |
0 |
0 |
0 |
0.000 |
| Average: |
92.0 |
-1.3 |
0.273 |
0 |
0 |
0 |
0.000 |
| 25 |
51 |
|
K |
8 |
4 |
16710 |
◊ |
E |
x-1,y+1,z |
1_465 |
13 |
3 |
17019 |
86.9 |
-1.3 |
0.291 |
0 |
0 |
0 |
0.000 |
| 26 |
52 |
|
G |
10 |
3 |
16837 |
x |
G |
x-1,y,z |
1_455 |
12 |
4 |
16837 |
86.7 |
-0.7 |
0.380 |
0 |
2 |
0 |
0.000 |
| 27 |
53 |
|
B |
5 |
2 |
17028 |
◊ |
G |
x-1,y,z |
1_455 |
8 |
2 |
16837 |
54.8 |
0.4 |
0.704 |
1 |
0 |
0 |
0.000 |
| 28 |
54 |
|
I |
6 |
2 |
16803 |
◊ |
C |
x,y,z |
1_555 |
7 |
2 |
16922 |
52.7 |
-0.1 |
0.431 |
0 |
1 |
0 |
0.000 |
55 |
|
E |
7 |
3 |
17019 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
16909 |
40.3 |
-0.3 |
0.483 |
0 |
0 |
0 |
0.000 |
| Average: |
46.5 |
-0.2 |
0.457 |
0 |
1 |
0 |
0.000 |
| 29 |
56 |
|
L |
10 |
5 |
16917 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
16909 |
49.7 |
1.4 |
0.785 |
1 |
0 |
0 |
0.000 |
57 |
|
C |
4 |
2 |
16922 |
◊ |
B |
x,y-1,z |
1_545 |
6 |
3 |
17028 |
33.1 |
0.7 |
0.784 |
0 |
0 |
0 |
0.000 |
| Average: |
41.4 |
1.0 |
0.784 |
1 |
0 |
0 |
0.000 |
| 30 |
58 |
|
[PLP]H:401 |
4 |
1 |
389 |
◊ |
L |
x,y,z |
1_555 |
4 |
1 |
16917 |
49.3 |
-0.4 |
0.569 |
1 |
0 |
0 |
0.044 |
59 |
|
[PLP]C:401 |
4 |
1 |
387 |
◊ |
E |
x,y,z |
1_555 |
4 |
1 |
17019 |
48.7 |
-0.6 |
0.564 |
1 |
0 |
0 |
0.044 |
60 |
|
[PLP]A:401 |
5 |
1 |
389 |
◊ |
I |
x,y,z |
1_555 |
4 |
1 |
16803 |
47.9 |
-0.5 |
0.573 |
1 |
0 |
0 |
0.044 |
61 |
|
[PLP]D:401 |
4 |
1 |
389 |
◊ |
G |
x,y,z |
1_555 |
4 |
1 |
16837 |
47.8 |
-0.6 |
0.558 |
1 |
0 |
0 |
0.044 |
62 |
|
[PLP]G:401 |
5 |
1 |
390 |
◊ |
D |
x,y,z |
1_555 |
4 |
1 |
17118 |
47.5 |
-0.4 |
0.576 |
1 |
0 |
0 |
0.044 |
63 |
|
[PLP]I:401 |
3 |
1 |
388 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
16909 |
47.4 |
-0.5 |
0.551 |
1 |
0 |
0 |
0.044 |
64 |
|
[PLP]B:401 |
5 |
1 |
389 |
◊ |
K |
x,y,z |
1_555 |
4 |
1 |
16710 |
47.3 |
-0.6 |
0.578 |
1 |
0 |
0 |
0.044 |
65 |
|
[PLP]E:401 |
5 |
1 |
388 |
◊ |
C |
x,y,z |
1_555 |
4 |
1 |
16922 |
46.8 |
-0.5 |
0.568 |
1 |
0 |
0 |
0.044 |
66 |
|
[PLP]L:401 |
5 |
1 |
387 |
◊ |
H |
x,y,z |
1_555 |
4 |
1 |
17127 |
46.4 |
-0.7 |
0.544 |
1 |
0 |
0 |
0.044 |
67 |
|
[PLP]K:401 |
4 |
1 |
388 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
17028 |
45.4 |
-0.6 |
0.555 |
1 |
0 |
0 |
0.044 |
| Average: |
47.5 |
-0.5 |
0.564 |
1 |
0 |
0 |
0.044 |
| 31 |
68 |
|
[PLP]F:401 |
5 |
1 |
389 |
◊ |
J |
x,y,z |
1_555 |
4 |
1 |
16641 |
48.1 |
-0.6 |
0.568 |
1 |
0 |
0 |
0.042 |
69 |
|
[PLP]J:401 |
3 |
1 |
386 |
◊ |
F |
x,y,z |
1_555 |
4 |
1 |
17085 |
46.7 |
-0.4 |
0.556 |
1 |
0 |
0 |
0.042 |
| Average: |
47.4 |
-0.5 |
0.562 |
1 |
0 |
0 |
0.042 |
| 32 |
70 |
|
H |
2 |
1 |
17127 |
◊ |
I |
x-1,y,z |
1_455 |
4 |
1 |
16803 |
21.5 |
0.0 |
0.581 |
0 |
0 |
0 |
0.000 |
| 33 |
71 |
|
F |
2 |
1 |
17085 |
◊ |
I |
x-1,y,z |
1_455 |
1 |
1 |
16803 |
8.7 |
0.4 |
0.832 |
0 |
0 |
0 |
0.000 |
| 34 |
72 |
|
E |
2 |
1 |
17019 |
x |
E |
x-1,y,z |
1_455 |
1 |
1 |
17019 |
7.7 |
0.3 |
0.812 |
0 |
0 |
0 |
0.000 |
|