## |
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 |
401 |
100 |
21143 |
◊ |
A |
x,y,z |
1_555 |
393 |
99 |
20857 |
3711.0 |
-26.1 |
0.075 |
49 |
25 |
0 |
0.615 |
2 |
|
D |
386 |
96 |
20913 |
◊ |
C |
x,y,z |
1_555 |
387 |
98 |
20999 |
3606.1 |
-25.7 |
0.081 |
48 |
25 |
0 |
0.615 |
Average: |
3658.5 |
-25.9 |
0.078 |
49 |
25 |
0 |
0.615 |
2 |
3 |
|
D |
82 |
25 |
20913 |
◊ |
A |
x,y,z |
1_555 |
79 |
25 |
20857 |
678.9 |
-0.4 |
0.579 |
1 |
9 |
0 |
0.000 |
3 |
4 |
|
A |
59 |
15 |
20857 |
◊ |
C |
-x+1/2,y-1/2,-z+1 |
3_546 |
57 |
15 |
20999 |
589.0 |
-5.9 |
0.179 |
5 |
2 |
0 |
0.000 |
5 |
|
B |
60 |
17 |
21143 |
◊ |
D |
-x+1/2,y-1/2,-z+1 |
3_546 |
54 |
15 |
20913 |
529.3 |
-5.0 |
0.222 |
2 |
3 |
0 |
0.000 |
Average: |
559.2 |
-5.4 |
0.201 |
4 |
3 |
0 |
0.000 |
4 |
6 |
|
D |
55 |
15 |
20913 |
◊ |
A |
x,y,z-1 |
1_554 |
48 |
13 |
20857 |
488.8 |
-1.0 |
0.513 |
2 |
1 |
0 |
0.000 |
5 |
7 |
|
D |
55 |
16 |
20913 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
52 |
16 |
21143 |
485.4 |
5.8 |
0.872 |
5 |
8 |
0 |
0.000 |
6 |
8 |
|
[HAM]A:423 |
33 |
1 |
677 |
f |
A |
x,y,z |
1_555 |
71 |
32 |
20857 |
474.0 |
1.0 |
0.648 |
10 |
0 |
0 |
0.082 |
9 |
|
[HAM]D:423 |
33 |
1 |
675 |
f |
D |
x,y,z |
1_555 |
69 |
32 |
20913 |
473.4 |
0.6 |
0.642 |
11 |
0 |
0 |
0.082 |
10 |
|
[HAM]C:423 |
33 |
1 |
677 |
f |
C |
x,y,z |
1_555 |
69 |
30 |
20999 |
469.7 |
1.0 |
0.643 |
8 |
0 |
0 |
0.082 |
11 |
|
[HAM]B:423 |
33 |
1 |
674 |
f |
B |
x,y,z |
1_555 |
64 |
31 |
21143 |
466.4 |
0.7 |
0.615 |
8 |
0 |
0 |
0.082 |
Average: |
470.8 |
0.8 |
0.637 |
9 |
0 |
0 |
0.082 |
7 |
12 |
|
B |
42 |
11 |
21143 |
◊ |
C |
x-1/2,-y+1/2,-z+1 |
4_456 |
47 |
13 |
20999 |
394.6 |
-1.0 |
0.511 |
7 |
8 |
0 |
0.000 |
8 |
13 |
|
A |
37 |
12 |
20857 |
◊ |
C |
-x+1/2,y-1/2,-z+2 |
3_547 |
37 |
12 |
20999 |
362.5 |
-2.9 |
0.312 |
0 |
0 |
0 |
0.000 |
9 |
14 |
|
A |
36 |
8 |
20857 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
38 |
11 |
21143 |
315.0 |
-0.1 |
0.571 |
1 |
4 |
0 |
0.000 |
10 |
15 |
|
A |
34 |
13 |
20857 |
◊ |
D |
-x+1/2,y-1/2,-z+1 |
3_546 |
36 |
14 |
20913 |
262.4 |
3.0 |
0.819 |
0 |
4 |
0 |
0.000 |
16 |
|
B |
25 |
10 |
21143 |
◊ |
C |
-x+1/2,y-1/2,-z+1 |
3_546 |
27 |
9 |
20999 |
185.1 |
2.4 |
0.804 |
1 |
2 |
0 |
0.000 |
Average: |
223.8 |
2.7 |
0.811 |
1 |
3 |
0 |
0.000 |
11 |
17 |
|
B |
24 |
6 |
21143 |
◊ |
A |
x,y,z-1 |
1_554 |
29 |
8 |
20857 |
207.4 |
1.4 |
0.685 |
3 |
4 |
0 |
0.000 |
18 |
|
D |
20 |
5 |
20913 |
◊ |
C |
x,y,z-1 |
1_554 |
23 |
7 |
20999 |
174.1 |
1.9 |
0.779 |
1 |
2 |
0 |
0.000 |
Average: |
190.8 |
1.6 |
0.732 |
2 |
3 |
0 |
0.000 |
12 |
19 |
|
D |
21 |
5 |
20913 |
◊ |
D |
-x+1,-y+1,z |
2_665 |
21 |
5 |
20913 |
174.0 |
-1.2 |
0.425 |
2 |
4 |
0 |
0.000 |
13 |
20 |
|
C |
22 |
5 |
20999 |
◊ |
A |
x,y,z |
1_555 |
21 |
7 |
20857 |
156.0 |
0.3 |
0.619 |
3 |
0 |
0 |
0.000 |
14 |
21 |
|
A |
16 |
4 |
20857 |
◊ |
A |
-x+1,-y,z |
2_655 |
15 |
4 |
20857 |
136.3 |
2.9 |
0.875 |
6 |
2 |
0 |
0.000 |
22 |
|
C |
12 |
4 |
20999 |
◊ |
C |
-x,-y+1,z |
2_565 |
11 |
3 |
20999 |
115.9 |
2.2 |
0.855 |
2 |
2 |
0 |
0.000 |
Average: |
126.1 |
2.5 |
0.865 |
4 |
2 |
0 |
0.000 |
15 |
23 |
|
A |
18 |
4 |
20857 |
◊ |
C |
x-1/2,-y+1/2,-z+1 |
4_456 |
13 |
4 |
20999 |
121.8 |
1.4 |
0.733 |
2 |
4 |
0 |
0.000 |
16 |
24 |
|
B |
16 |
6 |
21143 |
x |
B |
x,y,z-1 |
1_554 |
6 |
2 |
21143 |
100.8 |
-0.9 |
0.342 |
1 |
0 |
0 |
0.000 |
25 |
|
D |
11 |
3 |
20913 |
x |
D |
x,y,z-1 |
1_554 |
5 |
2 |
20913 |
70.9 |
-1.6 |
0.143 |
0 |
0 |
0 |
0.000 |
Average: |
85.9 |
-1.3 |
0.242 |
1 |
0 |
0 |
0.000 |
17 |
26 |
|
D |
13 |
6 |
20913 |
◊ |
B |
x,y,z |
1_555 |
12 |
5 |
21143 |
95.9 |
1.2 |
0.722 |
0 |
0 |
0 |
0.000 |
18 |
27 |
|
[SO4]C:422 |
5 |
1 |
183 |
f |
C |
x,y,z |
1_555 |
13 |
5 |
20999 |
81.4 |
-11.6 |
0.772 |
3 |
0 |
0 |
0.155 |
19 |
28 |
|
[SO4]D:422 |
5 |
1 |
183 |
f |
D |
x,y,z |
1_555 |
14 |
5 |
20913 |
81.3 |
-11.5 |
0.783 |
4 |
0 |
0 |
0.158 |
20 |
29 |
|
[SO4]A:422 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
20857 |
79.6 |
-11.4 |
0.724 |
4 |
0 |
0 |
0.157 |
21 |
30 |
|
[SO4]B:422 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
21143 |
79.3 |
-11.0 |
0.734 |
4 |
0 |
0 |
0.152 |
22 |
31 |
|
B |
11 |
5 |
21143 |
◊ |
D |
-x+1/2,y-1/2,-z |
3_545 |
11 |
4 |
20913 |
78.6 |
0.1 |
0.618 |
0 |
0 |
0 |
0.000 |
23 |
32 |
|
A |
6 |
2 |
20857 |
x |
A |
x,y,z-1 |
1_554 |
9 |
5 |
20857 |
66.0 |
-1.1 |
0.261 |
0 |
0 |
0 |
0.000 |
33 |
|
C |
4 |
1 |
20999 |
x |
C |
x,y,z-1 |
1_554 |
6 |
3 |
20999 |
43.3 |
-0.9 |
0.267 |
0 |
0 |
0 |
0.000 |
Average: |
54.6 |
-1.0 |
0.264 |
0 |
0 |
0 |
0.000 |
24 |
34 |
|
B |
1 |
1 |
21143 |
◊ |
C |
x,y,z-1 |
1_554 |
4 |
2 |
20999 |
11.4 |
0.5 |
0.811 |
0 |
0 |
0 |
0.000 |
25 |
35 |
|
D |
1 |
1 |
20913 |
◊ |
C |
-x+1,-y+1,z |
2_665 |
2 |
1 |
20999 |
2.9 |
-0.0 |
0.527 |
0 |
0 |
0 |
0.000 |
|