## |
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 |
|
C |
97 |
30 |
11565 |
◊ |
B |
y,x-1,-z |
4_545 |
93 |
30 |
11395 |
866.2 |
-8.9 |
0.146 |
4 |
0 |
0 |
0.086 |
2 |
|
A |
91 |
29 |
11496 |
◊ |
B |
x-y-1,-y-1,-z-1/3 |
5_444 |
82 |
25 |
11395 |
784.6 |
-5.3 |
0.373 |
4 |
0 |
0 |
0.086 |
3 |
|
C |
90 |
29 |
11565 |
◊ |
A |
-y-1,x-y-1,z+1/3 |
2_445 |
86 |
28 |
11496 |
758.4 |
-6.4 |
0.308 |
6 |
0 |
0 |
0.086 |
Average: |
803.1 |
-6.9 |
0.276 |
5 |
0 |
0 |
0.086 |
2 |
4 |
|
C |
51 |
15 |
11565 |
◊ |
A |
y,x,-z |
4_555 |
46 |
15 |
11496 |
499.2 |
-3.7 |
0.359 |
5 |
3 |
0 |
0.000 |
5 |
|
B |
47 |
16 |
11395 |
◊ |
B |
x-y,-y,-z-1/3 |
5_554 |
47 |
16 |
11395 |
454.9 |
-4.0 |
0.309 |
2 |
0 |
0 |
0.000 |
Average: |
477.1 |
-3.8 |
0.334 |
4 |
2 |
0 |
0.000 |
3 |
6 |
|
C |
48 |
9 |
11565 |
◊ |
B |
-x,-x+y,-z+1/3 |
6_555 |
54 |
15 |
11395 |
401.2 |
-5.5 |
0.201 |
1 |
0 |
0 |
0.000 |
4 |
7 |
|
C |
40 |
12 |
11565 |
◊ |
C |
-x,-x+y,-z+1/3 |
6_555 |
40 |
12 |
11565 |
397.1 |
3.6 |
0.894 |
5 |
4 |
0 |
0.000 |
8 |
|
B |
36 |
11 |
11395 |
◊ |
A |
x,y,z |
1_555 |
39 |
10 |
11496 |
393.1 |
4.5 |
0.935 |
8 |
13 |
0 |
0.000 |
Average: |
395.1 |
4.1 |
0.915 |
7 |
9 |
0 |
0.000 |
5 |
9 |
|
B |
37 |
11 |
11395 |
◊ |
A |
-x,-x+y,-z-2/3 |
6_554 |
48 |
12 |
11496 |
372.0 |
-4.2 |
0.261 |
1 |
0 |
0 |
0.000 |
6 |
10 |
|
C |
34 |
12 |
11565 |
◊ |
A |
x,y,z |
1_555 |
32 |
10 |
11496 |
275.3 |
-5.0 |
0.139 |
0 |
0 |
0 |
0.000 |
7 |
11 |
|
[SO4]A:907 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
16 |
11 |
11496 |
113.2 |
-14.9 |
0.862 |
2 |
0 |
0 |
0.051 |
8 |
12 |
|
[SO4]C:907 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
15 |
8 |
11565 |
112.6 |
-14.8 |
0.898 |
2 |
0 |
0 |
0.050 |
9 |
13 |
|
[SO4]A:902 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
11496 |
103.2 |
-16.0 |
0.831 |
8 |
0 |
0 |
0.063 |
10 |
14 |
|
[SO4]B:902 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
17 |
9 |
11395 |
99.5 |
-15.0 |
0.708 |
6 |
0 |
0 |
0.057 |
11 |
15 |
|
[SO4]C:908 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
13 |
6 |
11565 |
84.0 |
-10.0 |
0.962 |
3 |
0 |
0 |
0.036 |
12 |
16 |
|
[SO4]C:901 |
5 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
12 |
7 |
11565 |
83.1 |
-12.7 |
0.769 |
1 |
0 |
0 |
0.042 |
13 |
17 |
|
[SO4]C:903 |
5 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
13 |
6 |
11565 |
83.0 |
-11.6 |
0.806 |
2 |
0 |
0 |
0.040 |
14 |
18 |
|
[SO4]A:903 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
11496 |
82.4 |
-11.7 |
0.830 |
3 |
0 |
0 |
0.042 |
15 |
19 |
|
[SO4]B:901 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
11 |
7 |
11395 |
76.7 |
-11.8 |
0.590 |
1 |
0 |
0 |
0.039 |
16 |
20 |
|
[SO4]A:901 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
8 |
11496 |
74.1 |
-11.8 |
0.434 |
2 |
0 |
0 |
0.041 |
17 |
21 |
|
[SO4]C:902 |
5 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
14 |
5 |
11565 |
74.1 |
-11.1 |
0.673 |
1 |
0 |
0 |
0.037 |
18 |
22 |
|
[SO4]A:904 |
5 |
1 |
184 |
f |
A |
-y-1,x-y-1,z+1/3 |
2_445 |
10 |
3 |
11496 |
72.3 |
-8.7 |
0.874 |
2 |
0 |
0 |
0.031 |
19 |
23 |
|
[SO4]A:906 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
11496 |
69.1 |
-9.3 |
0.890 |
3 |
0 |
0 |
0.034 |
20 |
24 |
|
[SO4]B:903 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
11395 |
67.5 |
-9.0 |
0.860 |
3 |
0 |
0 |
0.033 |
21 |
25 |
|
[SO4]B:905 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
11395 |
66.0 |
-9.3 |
0.474 |
2 |
0 |
0 |
0.033 |
22 |
26 |
|
[SO4]A:905 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
11496 |
64.8 |
-8.4 |
0.817 |
2 |
0 |
0 |
0.030 |
23 |
27 |
|
[SO4]C:904 |
5 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
11 |
5 |
11565 |
61.4 |
-8.3 |
0.515 |
1 |
0 |
0 |
0.028 |
24 |
28 |
|
[SO4]C:905 |
5 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
16 |
4 |
11565 |
60.8 |
-7.2 |
0.781 |
2 |
0 |
0 |
0.026 |
25 |
29 |
|
[SO4]C:905 |
5 |
1 |
184 |
◊ |
A |
-y-1,x-y-1,z+1/3 |
2_445 |
14 |
4 |
11496 |
60.7 |
-6.9 |
0.879 |
2 |
0 |
0 |
0.025 |
26 |
30 |
|
[SO4]C:905 |
5 |
1 |
184 |
◊ |
B |
y,x-1,-z |
4_545 |
12 |
4 |
11395 |
58.1 |
-6.5 |
0.853 |
2 |
0 |
0 |
0.024 |
27 |
31 |
|
[SO4]A:904 |
4 |
1 |
184 |
◊ |
B |
x-y-1,-y-1,-z-1/3 |
5_444 |
7 |
4 |
11395 |
57.5 |
-6.1 |
0.945 |
3 |
0 |
0 |
0.000 |
28 |
32 |
|
[SO4]B:904 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
11395 |
54.7 |
-6.7 |
0.934 |
2 |
0 |
0 |
0.024 |
29 |
33 |
|
A |
4 |
2 |
11496 |
x |
A |
-y-1,x-y-1,z+1/3 |
2_445 |
4 |
1 |
11496 |
51.8 |
1.2 |
0.843 |
0 |
0 |
0 |
0.000 |
30 |
34 |
|
[SO4]C:906 |
4 |
1 |
186 |
◊ |
A |
-y-1,x-y-1,z+1/3 |
2_445 |
5 |
4 |
11496 |
51.4 |
-5.4 |
0.951 |
0 |
0 |
0 |
0.017 |
31 |
35 |
|
C |
5 |
4 |
11565 |
◊ |
[SO4]B:904 |
y,x-1,-z |
4_545 |
3 |
1 |
184 |
50.6 |
-5.5 |
0.910 |
0 |
0 |
0 |
0.018 |
32 |
36 |
|
[SO4]C:909 |
4 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
7 |
2 |
11565 |
49.8 |
-6.7 |
0.679 |
2 |
0 |
0 |
0.024 |
33 |
37 |
|
[SO4]C:906 |
5 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
5 |
2 |
11565 |
48.5 |
-5.6 |
0.962 |
1 |
0 |
0 |
0.019 |
34 |
38 |
|
C |
4 |
2 |
11565 |
◊ |
[SO4]A:905 |
-y-1,x-y-1,z+1/3 |
2_445 |
4 |
1 |
185 |
42.9 |
-5.3 |
0.725 |
1 |
0 |
0 |
0.018 |
35 |
39 |
|
C |
5 |
2 |
11565 |
x |
C |
-y-1,x-y-1,z+1/3 |
2_445 |
3 |
2 |
11565 |
38.9 |
-1.0 |
0.178 |
0 |
0 |
0 |
0.000 |
36 |
40 |
|
[SO4]C:906 |
3 |
1 |
186 |
◊ |
C |
-y-1,x-y-1,z+1/3 |
2_445 |
6 |
3 |
11565 |
36.6 |
-4.8 |
0.510 |
0 |
0 |
0 |
0.000 |
37 |
41 |
|
[SO4]A:904 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
11496 |
34.0 |
-4.0 |
0.953 |
1 |
0 |
0 |
0.000 |
38 |
42 |
|
[SO4]C:904 |
3 |
1 |
186 |
◊ |
B |
y,x-1,-z |
4_545 |
6 |
2 |
11395 |
32.9 |
-4.2 |
0.758 |
0 |
0 |
0 |
0.014 |
39 |
43 |
|
A |
3 |
2 |
11496 |
◊ |
[SO4]B:905 |
x-y-1,-y-1,-z-1/3 |
5_444 |
4 |
1 |
185 |
32.1 |
-4.4 |
0.671 |
1 |
0 |
0 |
0.016 |
40 |
44 |
|
[SO4]C:902 |
3 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
11496 |
31.0 |
-4.1 |
0.618 |
0 |
0 |
0 |
0.000 |
41 |
45 |
|
[SO4]B:902 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
11496 |
29.4 |
-3.6 |
0.466 |
0 |
0 |
0 |
0.000 |
42 |
46 |
|
[SO4]A:902 |
4 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
11395 |
27.5 |
-3.3 |
0.509 |
0 |
0 |
0 |
0.000 |
43 |
47 |
|
[SO4]B:904 |
2 |
1 |
184 |
◊ |
A |
-x,-x+y,-z-2/3 |
6_554 |
1 |
1 |
11496 |
4.1 |
-0.5 |
0.869 |
0 |
0 |
0 |
0.000 |
44 |
48 |
|
[SO4]C:905 |
1 |
1 |
184 |
◊ |
[SO4]A:904 |
-y-1,x-y-1,z+1/3 |
2_445 |
1 |
1 |
184 |
0.8 |
-0.2 |
1.000 |
0 |
0 |
0 |
0.000 |
|