## |
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 |
225 |
70 |
10117 |
◊ |
A |
x,y,z |
1_555 |
184 |
37 |
4893 |
2036.9 |
-22.7 |
0.258 |
31 |
6 |
0 |
0.589 |
2 |
|
D |
235 |
68 |
9678 |
◊ |
C |
x,y,z |
1_555 |
179 |
37 |
4812 |
2012.2 |
-22.1 |
0.287 |
27 |
4 |
0 |
0.589 |
Average: |
2024.6 |
-22.4 |
0.272 |
29 |
5 |
0 |
0.589 |
2 |
3 |
|
B |
93 |
29 |
10117 |
◊ |
D |
-x+1/2,-y-1/2,z-1/2 |
6_544 |
90 |
27 |
9678 |
807.8 |
-11.2 |
0.125 |
5 |
0 |
0 |
0.311 |
3 |
4 |
|
C |
56 |
12 |
4812 |
◊ |
A |
x,y,z |
1_555 |
51 |
12 |
4893 |
406.7 |
0.8 |
0.898 |
13 |
4 |
0 |
0.020 |
4 |
5 |
|
B |
40 |
10 |
10117 |
◊ |
B |
x,-y,-z |
4_555 |
40 |
10 |
10117 |
350.3 |
-4.3 |
0.283 |
6 |
0 |
0 |
0.022 |
5 |
6 |
|
D |
26 |
9 |
9678 |
◊ |
B |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
27 |
12 |
10117 |
230.5 |
-0.1 |
0.545 |
1 |
1 |
0 |
0.004 |
6 |
7 |
|
F |
22 |
3 |
707 |
◊ |
B |
x,y,z |
1_555 |
40 |
13 |
10117 |
227.3 |
-0.9 |
0.525 |
3 |
1 |
0 |
0.015 |
7 |
8 |
|
[OAR]F:5 |
11 |
1 |
341 |
cf |
B |
x,y,z |
1_555 |
34 |
13 |
10117 |
156.3 |
-0.9 |
0.430 |
5 |
0 |
0 |
0.072 |
8 |
9 |
|
E |
11 |
1 |
344 |
◊ |
D |
x,y,z |
1_555 |
33 |
13 |
9678 |
142.4 |
0.9 |
0.560 |
6 |
1 |
0 |
0.034 |
9 |
10 |
|
B |
19 |
6 |
10117 |
◊ |
D |
x-1/2,-y-1/2,-z+1 |
8_446 |
14 |
4 |
9678 |
130.0 |
-1.6 |
0.320 |
0 |
0 |
0 |
0.000 |
10 |
11 |
|
[OAR]E:5 |
8 |
1 |
346 |
◊ |
D |
x,y,z |
1_555 |
25 |
9 |
9678 |
119.4 |
-0.8 |
0.385 |
2 |
0 |
0 |
0.031 |
11 |
12 |
|
D |
14 |
4 |
9678 |
◊ |
D |
x,-y-1,-z+1 |
4_546 |
14 |
4 |
9678 |
115.3 |
-2.7 |
0.182 |
0 |
0 |
0 |
0.009 |
12 |
13 |
|
D |
13 |
5 |
9678 |
◊ |
B |
x,y,z |
1_555 |
12 |
5 |
10117 |
106.4 |
-0.6 |
0.528 |
0 |
0 |
0 |
0.000 |
13 |
14 |
|
F |
7 |
2 |
707 |
◊ |
A |
x,y,z |
1_555 |
15 |
5 |
4893 |
94.6 |
1.5 |
0.754 |
2 |
0 |
0 |
0.000 |
14 |
15 |
|
B |
6 |
2 |
10117 |
◊ |
C |
-x+1/2,-y-1/2,z-1/2 |
6_544 |
8 |
4 |
4812 |
82.9 |
1.3 |
0.824 |
2 |
3 |
0 |
0.000 |
15 |
16 |
|
[OAR]F:5 |
9 |
1 |
341 |
c |
F |
x,y,z |
1_555 |
8 |
3 |
707 |
77.3 |
0.3 |
0.527 |
0 |
0 |
0 |
0.000 |
16 |
17 |
|
[SO4]F:101 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
10117 |
75.2 |
-10.3 |
0.758 |
1 |
0 |
0 |
0.249 |
17 |
18 |
|
[SO4]A:101 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
4893 |
72.6 |
-9.8 |
0.812 |
2 |
0 |
0 |
0.151 |
18 |
19 |
|
A |
10 |
4 |
4893 |
◊ |
D |
x-1/2,-y-1/2,-z+1 |
8_446 |
8 |
4 |
9678 |
72.0 |
0.4 |
0.705 |
0 |
0 |
0 |
0.000 |
19 |
20 |
|
F |
7 |
2 |
707 |
◊ |
D |
-x+1/2,-y-1/2,z-1/2 |
6_544 |
12 |
5 |
9678 |
68.1 |
-1.3 |
0.338 |
0 |
0 |
0 |
0.009 |
20 |
21 |
|
D |
11 |
4 |
9678 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
4893 |
67.7 |
0.9 |
0.792 |
1 |
0 |
0 |
0.000 |
22 |
|
B |
10 |
4 |
10117 |
◊ |
C |
x,y,z |
1_555 |
6 |
2 |
4812 |
62.7 |
0.9 |
0.799 |
1 |
0 |
0 |
0.000 |
Average: |
65.2 |
0.9 |
0.795 |
1 |
0 |
0 |
0.000 |
21 |
23 |
|
[SO4]E:101 |
5 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
13 |
7 |
9678 |
64.7 |
-8.0 |
0.771 |
1 |
0 |
0 |
0.195 |
22 |
24 |
|
[OAR]E:5 |
6 |
1 |
346 |
◊ |
C |
x,y,z |
1_555 |
12 |
4 |
4812 |
64.7 |
0.4 |
0.632 |
2 |
0 |
0 |
0.003 |
23 |
25 |
|
[SO4]D:201 |
4 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
8 |
3 |
4812 |
55.8 |
-7.5 |
0.754 |
1 |
0 |
0 |
0.135 |
24 |
26 |
|
[SO4]D:201 |
4 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
6 |
3 |
9678 |
51.2 |
-6.9 |
0.689 |
2 |
0 |
0 |
0.133 |
25 |
27 |
|
[BEZ]F:1 |
5 |
1 |
257 |
cf |
F |
x,y,z |
1_555 |
8 |
3 |
707 |
50.2 |
0.3 |
0.092 |
0 |
0 |
0 |
0.000 |
26 |
28 |
|
[SO4]A:101 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
10117 |
49.8 |
-4.3 |
0.976 |
1 |
0 |
0 |
0.067 |
27 |
29 |
|
B |
7 |
2 |
10117 |
◊ |
[OAR]E:5 |
-x+1/2,-y-1/2,z-1/2 |
6_544 |
7 |
1 |
346 |
49.3 |
-0.1 |
0.338 |
0 |
0 |
0 |
0.003 |
28 |
30 |
|
[OAR]E:5 |
4 |
1 |
346 |
cf |
E |
x,y,z |
1_555 |
4 |
1 |
344 |
48.4 |
-0.4 |
0.367 |
0 |
0 |
0 |
0.100 |
29 |
31 |
|
[BEZ]F:1 |
4 |
1 |
257 |
◊ |
D |
-x+1/2,-y-1/2,z-1/2 |
6_544 |
7 |
5 |
9678 |
47.7 |
1.3 |
0.397 |
0 |
0 |
0 |
0.000 |
30 |
32 |
|
F |
4 |
1 |
707 |
◊ |
E |
-x+1/2,-y-1/2,z-1/2 |
6_544 |
5 |
1 |
344 |
46.9 |
0.1 |
0.451 |
0 |
0 |
0 |
0.000 |
31 |
33 |
|
[SO4]E:101 |
4 |
1 |
184 |
◊ |
E |
x,y,z |
1_555 |
5 |
1 |
344 |
46.3 |
-6.8 |
0.597 |
2 |
0 |
0 |
0.136 |
32 |
34 |
|
B |
6 |
5 |
10117 |
◊ |
B |
-x,y,-z+1/2 |
3_555 |
6 |
5 |
10117 |
45.7 |
0.8 |
0.788 |
0 |
0 |
0 |
0.000 |
33 |
35 |
|
[BEZ]F:1 |
8 |
1 |
257 |
◊ |
E |
-x+1/2,-y-1/2,z-1/2 |
6_544 |
7 |
1 |
344 |
45.2 |
1.1 |
0.078 |
0 |
0 |
0 |
0.000 |
34 |
36 |
|
C |
6 |
2 |
4812 |
◊ |
B |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
6 |
2 |
10117 |
44.1 |
0.3 |
0.702 |
0 |
1 |
0 |
0.000 |
35 |
37 |
|
B |
6 |
1 |
10117 |
◊ |
A |
x,-y,-z |
4_555 |
6 |
1 |
4893 |
42.2 |
-0.2 |
0.599 |
1 |
0 |
0 |
0.004 |
36 |
38 |
|
[BEZ]F:1 |
7 |
1 |
257 |
◊ |
[OAR]E:5 |
-x+1/2,-y-1/2,z-1/2 |
6_544 |
5 |
1 |
346 |
40.2 |
1.2 |
0.127 |
0 |
0 |
0 |
0.000 |
37 |
39 |
|
[SO4]D:201 |
4 |
1 |
185 |
◊ |
B |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
3 |
2 |
10117 |
38.8 |
-4.0 |
0.935 |
1 |
0 |
0 |
0.028 |
38 |
40 |
|
[OAR]F:5 |
5 |
1 |
341 |
f |
[SO4]F:101 |
x,y,z |
1_555 |
4 |
1 |
185 |
36.0 |
-4.1 |
0.700 |
0 |
0 |
0 |
0.095 |
39 |
41 |
|
[SO4]F:101 |
4 |
1 |
185 |
◊ |
D |
-x+1/2,-y-1/2,z-1/2 |
6_544 |
5 |
2 |
9678 |
34.0 |
-2.9 |
0.936 |
1 |
0 |
0 |
0.078 |
40 |
42 |
|
[BEZ]F:1 |
8 |
1 |
257 |
◊ |
[OAR]F:5 |
x,y,z |
1_555 |
5 |
1 |
341 |
33.2 |
1.1 |
0.061 |
0 |
0 |
0 |
0.000 |
41 |
43 |
|
[SO4]A:101 |
4 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
4812 |
27.5 |
-3.4 |
0.620 |
0 |
0 |
0 |
0.012 |
42 |
44 |
|
F |
5 |
2 |
707 |
◊ |
[SO4]E:101 |
-x+1/2,-y-1/2,z-1/2 |
6_544 |
4 |
1 |
184 |
25.7 |
-3.6 |
0.668 |
0 |
0 |
0 |
0.023 |
43 |
45 |
|
[BEZ]F:1 |
3 |
1 |
257 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
10117 |
23.3 |
0.3 |
0.180 |
0 |
0 |
0 |
0.000 |
44 |
46 |
|
[SO4]F:101 |
1 |
1 |
185 |
◊ |
F |
x,y,z |
1_555 |
3 |
1 |
707 |
22.5 |
-2.9 |
0.683 |
0 |
0 |
0 |
0.019 |
45 |
47 |
|
[BEZ]F:1 |
3 |
1 |
257 |
◊ |
C |
-x+1/2,-y-1/2,z-1/2 |
6_544 |
4 |
2 |
4812 |
17.8 |
0.3 |
0.218 |
0 |
0 |
0 |
0.000 |
46 |
48 |
|
D |
1 |
1 |
9678 |
◊ |
D |
-x+1,y,-z+3/2 |
3_656 |
1 |
1 |
9678 |
16.4 |
-0.5 |
0.168 |
0 |
0 |
0 |
0.000 |
47 |
49 |
|
[BEZ]F:1 |
2 |
1 |
257 |
◊ |
[SO4]E:101 |
-x+1/2,-y-1/2,z-1/2 |
6_544 |
4 |
1 |
184 |
15.1 |
-1.6 |
0.467 |
0 |
0 |
0 |
0.010 |
48 |
50 |
|
[OAR]E:5 |
2 |
1 |
346 |
◊ |
[SO4]E:101 |
x,y,z |
1_555 |
1 |
1 |
184 |
11.4 |
-1.5 |
0.685 |
0 |
0 |
0 |
0.027 |
49 |
51 |
|
D |
3 |
1 |
9678 |
◊ |
C |
-x+1,y,-z+3/2 |
3_656 |
3 |
1 |
4812 |
7.0 |
-0.0 |
0.579 |
0 |
0 |
0 |
0.000 |
50 |
52 |
|
A |
1 |
1 |
4893 |
◊ |
D |
-x+1/2,-y-1/2,z-1/2 |
6_544 |
2 |
2 |
9678 |
3.0 |
0.1 |
0.631 |
0 |
0 |
0 |
0.000 |
51 |
53 |
|
[OAR]F:5 |
1 |
1 |
341 |
◊ |
D |
-x+1/2,-y-1/2,z-1/2 |
6_544 |
1 |
1 |
9678 |
1.8 |
0.0 |
0.554 |
0 |
0 |
0 |
0.000 |
52 |
54 |
|
F |
1 |
1 |
707 |
◊ |
[OAR]E:5 |
-x+1/2,-y-1/2,z-1/2 |
6_544 |
1 |
1 |
346 |
1.0 |
0.0 |
0.674 |
0 |
0 |
0 |
0.000 |
53 |
55 |
|
B |
1 |
1 |
10117 |
◊ |
E |
-x+1/2,-y-1/2,z-1/2 |
6_544 |
1 |
1 |
344 |
0.2 |
-0.0 |
0.572 |
0 |
0 |
0 |
0.000 |
|