## |
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 |
|
H |
195 |
50 |
8863 |
◊ |
G |
x,y,z |
1_555 |
196 |
51 |
8779 |
1834.6 |
-7.3 |
0.245 |
46 |
0 |
0 |
0.815 |
2 |
|
D |
192 |
51 |
8914 |
◊ |
C |
x,y,z |
1_555 |
188 |
50 |
8704 |
1823.7 |
-9.0 |
0.202 |
44 |
0 |
0 |
0.815 |
3 |
|
B |
187 |
49 |
9015 |
◊ |
A |
x,y,z |
1_555 |
197 |
50 |
9024 |
1810.6 |
-10.4 |
0.158 |
46 |
0 |
0 |
0.815 |
4 |
|
F |
195 |
48 |
8895 |
◊ |
E |
x,y,z |
1_555 |
193 |
50 |
8797 |
1798.0 |
-8.8 |
0.231 |
41 |
0 |
0 |
0.815 |
Average: |
1816.7 |
-8.9 |
0.209 |
44 |
0 |
0 |
0.815 |
2 |
5 |
|
E |
62 |
20 |
8797 |
◊ |
H |
x-1,y-1,z |
1_445 |
73 |
20 |
8863 |
585.6 |
6.9 |
0.907 |
8 |
3 |
0 |
0.000 |
6 |
|
D |
70 |
19 |
8914 |
◊ |
A |
x,y,z |
1_555 |
63 |
18 |
9024 |
568.3 |
6.4 |
0.893 |
5 |
2 |
0 |
0.000 |
Average: |
576.9 |
6.6 |
0.900 |
7 |
3 |
0 |
0.000 |
3 |
7 |
|
[D3Y]D:201 |
31 |
1 |
626 |
f |
D |
x,y,z |
1_555 |
51 |
17 |
8914 |
372.7 |
0.6 |
0.302 |
5 |
0 |
0 |
0.144 |
8 |
|
[D3Y]E:201 |
27 |
1 |
604 |
f |
E |
x,y,z |
1_555 |
49 |
16 |
8797 |
359.5 |
0.7 |
0.339 |
7 |
0 |
0 |
0.144 |
9 |
|
[D3Y]H:201 |
29 |
1 |
606 |
f |
H |
x,y,z |
1_555 |
50 |
16 |
8863 |
351.9 |
0.4 |
0.311 |
7 |
0 |
0 |
0.144 |
10 |
|
[D3Y]B:201 |
29 |
1 |
605 |
f |
B |
x,y,z |
1_555 |
49 |
16 |
9015 |
349.8 |
0.5 |
0.337 |
7 |
0 |
0 |
0.144 |
11 |
|
[D3Y]F:201 |
29 |
1 |
611 |
f |
F |
x,y,z |
1_555 |
49 |
16 |
8895 |
346.4 |
0.3 |
0.321 |
7 |
0 |
0 |
0.144 |
12 |
|
[D3Y]C:201 |
29 |
1 |
614 |
f |
C |
x,y,z |
1_555 |
50 |
18 |
8704 |
345.9 |
0.9 |
0.324 |
6 |
0 |
0 |
0.144 |
13 |
|
[D3Y]A:201 |
29 |
1 |
603 |
f |
A |
x,y,z |
1_555 |
49 |
17 |
9024 |
344.5 |
0.9 |
0.327 |
7 |
0 |
0 |
0.144 |
14 |
|
[D3Y]G:201 |
29 |
1 |
605 |
f |
G |
x,y,z |
1_555 |
47 |
17 |
8779 |
341.2 |
0.8 |
0.336 |
7 |
0 |
0 |
0.144 |
Average: |
351.5 |
0.6 |
0.325 |
7 |
0 |
0 |
0.144 |
4 |
15 |
|
F |
39 |
14 |
8895 |
◊ |
G |
x,y-1,z |
1_545 |
46 |
15 |
8779 |
361.2 |
7.8 |
0.933 |
10 |
7 |
0 |
0.000 |
16 |
|
B |
37 |
15 |
9015 |
◊ |
C |
x-1,y,z |
1_455 |
37 |
16 |
8704 |
292.5 |
6.9 |
0.950 |
5 |
2 |
0 |
0.000 |
Average: |
326.8 |
7.3 |
0.941 |
8 |
5 |
0 |
0.000 |
5 |
17 |
|
A |
39 |
12 |
9024 |
◊ |
G |
-x+1,y-1/2,-z+1 |
2_646 |
38 |
11 |
8779 |
344.3 |
-2.3 |
0.292 |
2 |
2 |
0 |
0.000 |
18 |
|
E |
31 |
11 |
8797 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
30 |
8 |
8704 |
287.4 |
-1.4 |
0.390 |
3 |
2 |
0 |
0.000 |
Average: |
315.8 |
-1.8 |
0.341 |
3 |
2 |
0 |
0.000 |
6 |
19 |
|
B |
30 |
8 |
9015 |
◊ |
H |
-x+1,y-1/2,-z |
2_645 |
31 |
10 |
8863 |
312.6 |
-3.2 |
0.220 |
2 |
0 |
0 |
0.000 |
7 |
20 |
|
F |
33 |
8 |
8895 |
◊ |
D |
-x+1,y-1/2,-z |
2_645 |
32 |
12 |
8914 |
299.4 |
-0.9 |
0.430 |
1 |
1 |
0 |
0.000 |
8 |
21 |
|
H |
33 |
11 |
8863 |
◊ |
D |
x,y,z |
1_555 |
36 |
11 |
8914 |
298.2 |
-1.6 |
0.389 |
0 |
0 |
0 |
0.000 |
9 |
22 |
|
A |
23 |
6 |
9024 |
◊ |
C |
x-1,y,z |
1_455 |
34 |
9 |
8704 |
263.9 |
0.6 |
0.549 |
5 |
1 |
0 |
0.000 |
23 |
|
E |
20 |
5 |
8797 |
◊ |
G |
x,y-1,z |
1_545 |
30 |
10 |
8779 |
207.7 |
-0.7 |
0.452 |
5 |
1 |
0 |
0.000 |
Average: |
235.8 |
-0.0 |
0.501 |
5 |
1 |
0 |
0.000 |
10 |
24 |
|
F |
25 |
11 |
8895 |
◊ |
B |
x,y-1,z |
1_545 |
27 |
10 |
9015 |
204.7 |
1.0 |
0.643 |
0 |
0 |
0 |
0.000 |
11 |
25 |
|
F |
22 |
9 |
8895 |
◊ |
B |
x,y,z |
1_555 |
17 |
6 |
9015 |
134.4 |
1.1 |
0.663 |
1 |
0 |
0 |
0.000 |
12 |
26 |
|
[D3Y]C:201 |
8 |
1 |
614 |
◊ |
D |
x,y,z |
1_555 |
19 |
7 |
8914 |
126.6 |
-1.3 |
0.274 |
1 |
0 |
0 |
0.104 |
27 |
|
[D3Y]G:201 |
10 |
1 |
605 |
◊ |
H |
x,y,z |
1_555 |
18 |
7 |
8863 |
123.0 |
-1.3 |
0.279 |
1 |
0 |
0 |
0.104 |
28 |
|
[D3Y]A:201 |
11 |
1 |
603 |
◊ |
B |
x,y,z |
1_555 |
17 |
7 |
9015 |
122.1 |
-1.2 |
0.282 |
1 |
0 |
0 |
0.104 |
29 |
|
[D3Y]D:201 |
11 |
1 |
626 |
◊ |
C |
x,y,z |
1_555 |
14 |
6 |
8704 |
120.5 |
-0.9 |
0.307 |
1 |
0 |
0 |
0.104 |
30 |
|
[D3Y]F:201 |
10 |
1 |
611 |
◊ |
E |
x,y,z |
1_555 |
18 |
7 |
8797 |
118.0 |
-1.4 |
0.272 |
1 |
0 |
0 |
0.104 |
31 |
|
[D3Y]B:201 |
10 |
1 |
605 |
◊ |
A |
x,y,z |
1_555 |
16 |
7 |
9024 |
111.0 |
-1.3 |
0.275 |
1 |
0 |
0 |
0.104 |
32 |
|
[D3Y]E:201 |
10 |
1 |
604 |
◊ |
F |
x,y,z |
1_555 |
15 |
7 |
8895 |
110.9 |
-1.5 |
0.270 |
1 |
0 |
0 |
0.104 |
33 |
|
[D3Y]H:201 |
11 |
1 |
606 |
◊ |
G |
x,y,z |
1_555 |
13 |
6 |
8779 |
104.2 |
-1.4 |
0.278 |
1 |
0 |
0 |
0.104 |
Average: |
117.0 |
-1.3 |
0.279 |
1 |
0 |
0 |
0.104 |
13 |
34 |
|
A |
11 |
3 |
9024 |
◊ |
G |
x,y-1,z |
1_545 |
5 |
2 |
8779 |
72.9 |
1.1 |
0.740 |
2 |
0 |
0 |
0.000 |
14 |
35 |
|
C |
4 |
1 |
8704 |
◊ |
A |
x,y,z |
1_555 |
8 |
4 |
9024 |
46.1 |
1.3 |
0.825 |
1 |
0 |
0 |
0.000 |
36 |
|
E |
7 |
4 |
8797 |
◊ |
G |
x-1,y-1,z |
1_445 |
3 |
1 |
8779 |
44.3 |
0.9 |
0.789 |
1 |
0 |
0 |
0.000 |
Average: |
45.2 |
1.1 |
0.807 |
1 |
0 |
0 |
0.000 |
15 |
37 |
|
E |
4 |
1 |
8797 |
◊ |
[D3Y]C:201 |
-x+1,y-1/2,-z+1 |
2_646 |
6 |
1 |
614 |
38.7 |
0.9 |
0.625 |
0 |
0 |
0 |
0.000 |
38 |
|
A |
4 |
1 |
9024 |
◊ |
[D3Y]G:201 |
-x+1,y-1/2,-z+1 |
2_646 |
4 |
1 |
605 |
31.6 |
1.0 |
0.708 |
0 |
0 |
0 |
0.000 |
Average: |
35.1 |
1.0 |
0.667 |
0 |
0 |
0 |
0.000 |
16 |
39 |
|
D |
4 |
2 |
8914 |
◊ |
H |
x,y-1,z |
1_545 |
6 |
2 |
8863 |
33.8 |
-0.2 |
0.484 |
0 |
0 |
0 |
0.000 |
17 |
40 |
|
D |
5 |
2 |
8914 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
9015 |
31.1 |
0.3 |
0.678 |
0 |
0 |
0 |
0.000 |
18 |
41 |
|
G |
6 |
2 |
8779 |
◊ |
C |
x,y,z |
1_555 |
5 |
1 |
8704 |
30.3 |
0.3 |
0.661 |
1 |
1 |
0 |
0.000 |
19 |
42 |
|
B |
2 |
1 |
9015 |
◊ |
G |
x,y-1,z |
1_545 |
4 |
1 |
8779 |
28.5 |
0.2 |
0.598 |
0 |
0 |
0 |
0.000 |
20 |
43 |
|
H |
4 |
2 |
8863 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
8704 |
26.0 |
-0.0 |
0.569 |
0 |
0 |
0 |
0.000 |
44 |
|
G |
5 |
2 |
8779 |
◊ |
D |
x,y,z |
1_555 |
3 |
2 |
8914 |
16.3 |
0.3 |
0.696 |
0 |
0 |
0 |
0.000 |
Average: |
21.2 |
0.2 |
0.633 |
0 |
0 |
0 |
0.000 |
21 |
45 |
|
E |
3 |
3 |
8797 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
9024 |
16.6 |
-0.0 |
0.549 |
0 |
0 |
0 |
0.000 |
22 |
46 |
|
F |
3 |
3 |
8895 |
◊ |
[D3Y]D:201 |
-x+1,y-1/2,-z |
2_645 |
5 |
1 |
626 |
13.9 |
-0.2 |
0.448 |
0 |
0 |
0 |
0.000 |
23 |
47 |
|
F |
2 |
1 |
8895 |
◊ |
H |
x,y-1,z |
1_545 |
2 |
2 |
8863 |
12.4 |
-0.0 |
0.570 |
0 |
0 |
0 |
0.000 |
48 |
|
B |
1 |
1 |
9015 |
◊ |
D |
x-1,y,z |
1_455 |
1 |
1 |
8914 |
2.7 |
-0.1 |
0.414 |
0 |
0 |
0 |
0.000 |
Average: |
7.5 |
-0.1 |
0.492 |
0 |
0 |
0 |
0.000 |
24 |
49 |
|
F |
2 |
2 |
8895 |
◊ |
D |
x-1,y,z |
1_455 |
1 |
1 |
8914 |
9.9 |
-0.1 |
0.368 |
0 |
0 |
0 |
0.000 |
25 |
50 |
|
A |
1 |
1 |
9024 |
◊ |
G |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
8779 |
6.2 |
0.1 |
0.766 |
0 |
0 |
0 |
0.000 |
26 |
51 |
|
E |
1 |
1 |
8797 |
◊ |
C |
x-1,y-1,z |
1_445 |
2 |
1 |
8704 |
3.8 |
0.1 |
0.693 |
0 |
0 |
0 |
0.000 |
27 |
52 |
|
E |
1 |
1 |
8797 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
9015 |
3.1 |
-0.0 |
0.523 |
0 |
0 |
0 |
0.000 |
28 |
53 |
|
D |
1 |
1 |
8914 |
◊ |
G |
x,y-1,z |
1_545 |
1 |
1 |
8779 |
3.0 |
-0.1 |
0.394 |
0 |
0 |
0 |
0.000 |
|