| ## |
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 |
|
E |
214 |
31 |
13559 |
◊ |
D |
x,y,z |
1_555 |
191 |
65 |
38874 |
1788.4 |
-30.7 |
0.538 |
19 |
0 |
0 |
0.168 |
2 |
|
B |
194 |
29 |
13561 |
◊ |
A |
x,y,z |
1_555 |
190 |
65 |
39001 |
1709.4 |
-28.1 |
0.552 |
21 |
0 |
0 |
0.168 |
| Average: |
1748.9 |
-29.4 |
0.545 |
20 |
0 |
0 |
0.168 |
| 2 |
3 |
|
A |
125 |
36 |
39001 |
◊ |
A |
-x,y,-z |
2_555 |
124 |
36 |
39001 |
1179.5 |
-8.5 |
0.200 |
4 |
6 |
0 |
0.000 |
| 3 |
4 |
|
A |
75 |
24 |
39001 |
◊ |
D |
x,y-1,z |
1_545 |
82 |
26 |
38874 |
714.1 |
0.4 |
0.601 |
10 |
3 |
0 |
0.000 |
| 4 |
5 |
|
E |
77 |
15 |
13559 |
◊ |
B |
x,y,z |
1_555 |
77 |
15 |
13561 |
625.2 |
-12.6 |
0.930 |
7 |
0 |
0 |
1.000 |
| 5 |
6 |
|
A |
58 |
18 |
39001 |
x |
A |
-x+1/2,y-1/2,-z |
4_545 |
41 |
14 |
39001 |
476.8 |
-2.5 |
0.378 |
3 |
0 |
0 |
0.000 |
7 |
|
D |
38 |
12 |
38874 |
x |
D |
-x+1/2,y-1/2,-z+1 |
4_546 |
53 |
18 |
38874 |
428.6 |
-2.5 |
0.366 |
3 |
1 |
0 |
0.000 |
| Average: |
452.7 |
-2.5 |
0.372 |
3 |
1 |
0 |
0.000 |
| 6 |
8 |
|
[2AD]A:1893 |
18 |
1 |
426 |
cf |
A |
x,y,z |
1_555 |
40 |
16 |
39001 |
290.1 |
4.0 |
0.402 |
7 |
0 |
0 |
0.000 |
9 |
|
[2AD]D:1895 |
19 |
1 |
421 |
cf |
D |
x,y,z |
1_555 |
41 |
16 |
38874 |
276.2 |
3.7 |
0.376 |
6 |
0 |
0 |
0.000 |
| Average: |
283.2 |
3.9 |
0.389 |
7 |
0 |
0 |
0.000 |
| 7 |
10 |
|
[SO4]A:1889 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
20 |
8 |
39001 |
115.7 |
-16.3 |
0.753 |
4 |
0 |
0 |
0.078 |
| 8 |
11 |
|
[SO4]D:1889 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
18 |
8 |
38874 |
112.6 |
-15.0 |
0.760 |
4 |
0 |
0 |
0.072 |
| 9 |
12 |
|
[SO4]A:1881 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
39001 |
112.2 |
-16.2 |
0.716 |
5 |
0 |
0 |
0.080 |
| 10 |
13 |
|
[SO4]D:1881 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
17 |
7 |
38874 |
108.5 |
-15.2 |
0.797 |
5 |
0 |
0 |
0.075 |
| 11 |
14 |
|
[SO4]A:1891 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
39001 |
105.0 |
-17.0 |
0.591 |
2 |
0 |
0 |
0.077 |
| 12 |
15 |
|
B |
14 |
7 |
13561 |
◊ |
D |
x,y,z |
1_555 |
10 |
7 |
38874 |
99.0 |
-3.2 |
0.510 |
1 |
0 |
0 |
0.007 |
16 |
|
E |
3 |
1 |
13559 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
39001 |
10.6 |
0.4 |
0.716 |
0 |
0 |
0 |
0.007 |
| Average: |
54.8 |
-1.4 |
0.613 |
1 |
0 |
0 |
0.007 |
| 13 |
17 |
|
[SO4]D:1882 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
16 |
9 |
38874 |
98.8 |
-15.1 |
0.451 |
4 |
0 |
0 |
0.072 |
| 14 |
18 |
|
[SO4]A:1886 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
39001 |
95.0 |
-11.7 |
0.900 |
3 |
0 |
0 |
0.056 |
| 15 |
19 |
|
D |
12 |
4 |
38874 |
◊ |
A |
-x,y,-z |
2_555 |
13 |
3 |
39001 |
93.6 |
-0.8 |
0.449 |
0 |
0 |
0 |
0.000 |
| 16 |
20 |
|
[SO4]D:1885 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
19 |
7 |
38874 |
93.2 |
-12.7 |
0.835 |
3 |
0 |
0 |
0.060 |
| 17 |
21 |
|
[SO4]A:1882 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
39001 |
91.0 |
-13.5 |
0.533 |
3 |
0 |
0 |
0.064 |
| 18 |
22 |
|
[SO4]A:1884 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
39001 |
89.6 |
-12.2 |
0.833 |
3 |
0 |
0 |
0.059 |
| 19 |
23 |
|
[SO4]A:1880 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
39001 |
88.9 |
-11.7 |
0.680 |
1 |
0 |
0 |
0.052 |
| 20 |
24 |
|
[SO4]A:1890 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
39001 |
86.3 |
-12.1 |
0.712 |
1 |
0 |
0 |
0.054 |
| 21 |
25 |
|
[SO4]D:1892 |
5 |
1 |
187 |
f |
D |
x,y,z |
1_555 |
10 |
6 |
38874 |
85.5 |
-10.0 |
0.918 |
3 |
0 |
0 |
0.049 |
| 22 |
26 |
|
[SO4]D:1886 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
11 |
5 |
38874 |
84.1 |
-11.3 |
0.852 |
3 |
0 |
0 |
0.054 |
| 23 |
27 |
|
[SO4]D:1880 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
8 |
5 |
38874 |
83.4 |
-11.8 |
0.646 |
3 |
0 |
0 |
0.057 |
| 24 |
28 |
|
[SO4]A:1885 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
39001 |
80.7 |
-10.8 |
0.847 |
3 |
0 |
0 |
0.053 |
| 25 |
29 |
|
[SO4]D:1890 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
11 |
4 |
38874 |
78.1 |
-11.1 |
0.725 |
3 |
0 |
0 |
0.054 |
| 26 |
30 |
|
[HG]D:1879 |
1 |
1 |
137 |
f |
D |
x,y,z |
1_555 |
11 |
6 |
38874 |
77.3 |
-25.4 |
0.000 |
0 |
0 |
0 |
0.112 |
31 |
|
[HG]A:1879 |
1 |
1 |
137 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
39001 |
76.7 |
-26.0 |
0.000 |
0 |
0 |
0 |
0.112 |
| Average: |
77.0 |
-25.7 |
0.000 |
0 |
0 |
0 |
0.112 |
| 27 |
32 |
|
[SO4]D:1884 |
4 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
12 |
4 |
38874 |
76.7 |
-10.7 |
0.750 |
2 |
0 |
0 |
0.050 |
| 28 |
33 |
|
[SO4]A:1887 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
13 |
4 |
39001 |
76.5 |
-10.5 |
0.877 |
4 |
0 |
0 |
0.053 |
| 29 |
34 |
|
[SO4]D:1888 |
5 |
1 |
187 |
f |
D |
x,y,z |
1_555 |
16 |
5 |
38874 |
75.3 |
-11.3 |
0.644 |
3 |
0 |
0 |
0.054 |
| 30 |
35 |
|
[SO4]A:1888 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
39001 |
74.0 |
-11.5 |
0.606 |
2 |
0 |
0 |
0.054 |
| 31 |
36 |
|
[SO4]D:1887 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
8 |
3 |
38874 |
71.9 |
-10.7 |
0.596 |
2 |
0 |
0 |
0.050 |
| 32 |
37 |
|
[SO4]D:1891 |
4 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
11 |
3 |
38874 |
57.4 |
-7.4 |
0.757 |
0 |
0 |
0 |
0.032 |
| 33 |
38 |
|
[SO4]D:1883 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
8 |
4 |
38874 |
56.8 |
-6.6 |
0.877 |
2 |
0 |
0 |
0.032 |
| 34 |
39 |
|
[SO4]A:1883 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
39001 |
56.6 |
-6.3 |
0.882 |
3 |
0 |
0 |
0.033 |
| 35 |
40 |
|
[2AD]D:1895 |
5 |
1 |
421 |
◊ |
E |
x,y,z |
1_555 |
6 |
2 |
13559 |
48.2 |
1.2 |
0.553 |
0 |
0 |
0 |
0.002 |
41 |
|
[2AD]A:1893 |
5 |
1 |
426 |
◊ |
B |
x,y,z |
1_555 |
7 |
2 |
13561 |
45.2 |
-0.1 |
0.270 |
1 |
0 |
0 |
0.002 |
| Average: |
46.7 |
0.6 |
0.411 |
1 |
0 |
0 |
0.002 |
| 36 |
42 |
|
[SO4]D:1885 |
3 |
1 |
186 |
f |
[SO4]D:1882 |
x,y,z |
1_555 |
2 |
1 |
185 |
21.4 |
-4.9 |
0.976 |
0 |
0 |
0 |
0.021 |
| 37 |
43 |
|
[SO4]A:1885 |
3 |
1 |
186 |
f |
[SO4]A:1882 |
x,y,z |
1_555 |
2 |
1 |
185 |
14.8 |
-3.2 |
0.976 |
0 |
0 |
0 |
0.014 |
| 38 |
44 |
|
A |
3 |
2 |
39001 |
◊ |
[SO4]D:1891 |
x,y-1,z |
1_545 |
2 |
1 |
186 |
7.8 |
-0.9 |
0.809 |
0 |
0 |
0 |
0.000 |
|