## |
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 |
111 |
31 |
13803 |
◊ |
A |
x,y,z |
1_555 |
109 |
29 |
14170 |
1019.2 |
-7.7 |
0.260 |
6 |
4 |
0 |
0.061 |
2 |
2 |
|
A |
82 |
18 |
14170 |
x |
A |
-y,x-y,z |
2_555 |
89 |
26 |
14170 |
733.2 |
-6.2 |
0.287 |
9 |
1 |
0 |
0.108 |
3 |
|
B |
82 |
24 |
13803 |
x |
B |
-y,x-y,z |
2_555 |
79 |
18 |
13803 |
704.7 |
-6.1 |
0.230 |
7 |
3 |
0 |
0.108 |
Average: |
719.0 |
-6.1 |
0.258 |
8 |
2 |
0 |
0.108 |
3 |
4 |
|
[AR6]B:401 |
35 |
1 |
729 |
f |
B |
x,y,z |
1_555 |
83 |
30 |
13803 |
499.6 |
-7.3 |
0.595 |
20 |
0 |
0 |
0.182 |
5 |
|
[AR6]A:401 |
36 |
1 |
727 |
f |
A |
x,y,z |
1_555 |
84 |
30 |
14170 |
493.5 |
-6.7 |
0.651 |
17 |
0 |
0 |
0.182 |
Average: |
496.6 |
-7.0 |
0.623 |
19 |
0 |
0 |
0.182 |
4 |
6 |
|
A |
47 |
12 |
14170 |
x |
A |
-y,x-y+1,z |
2_565 |
41 |
13 |
14170 |
377.9 |
-6.1 |
0.142 |
1 |
0 |
0 |
0.000 |
5 |
7 |
|
[PG4]A:411 |
13 |
1 |
412 |
f |
A |
x,y,z |
1_555 |
43 |
16 |
14170 |
260.2 |
6.2 |
0.411 |
0 |
0 |
0 |
0.000 |
6 |
8 |
|
[QUE]B:407 |
21 |
1 |
446 |
f |
B |
x,y,z |
1_555 |
32 |
15 |
13803 |
257.4 |
-8.9 |
0.167 |
1 |
0 |
0 |
0.108 |
9 |
|
[QUE]A:408 |
20 |
1 |
450 |
f |
A |
x,y,z |
1_555 |
30 |
15 |
14170 |
246.0 |
-8.9 |
0.140 |
3 |
0 |
0 |
0.108 |
Average: |
251.7 |
-8.9 |
0.153 |
2 |
0 |
0 |
0.108 |
7 |
10 |
|
[PGE]B:408 |
10 |
1 |
336 |
f |
B |
x,y,z |
1_555 |
35 |
12 |
13803 |
207.5 |
5.3 |
0.365 |
1 |
0 |
0 |
0.000 |
8 |
11 |
|
A |
21 |
5 |
14170 |
◊ |
B |
x-y,x,z-1/2 |
6_554 |
20 |
5 |
13803 |
177.4 |
3.6 |
0.902 |
0 |
0 |
0 |
0.000 |
9 |
12 |
|
B |
11 |
4 |
13803 |
x |
B |
-y,x-y+1,z |
2_565 |
14 |
5 |
13803 |
93.0 |
0.2 |
0.542 |
0 |
0 |
0 |
0.000 |
10 |
13 |
|
[SO4]A:404 |
5 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
14170 |
92.4 |
-12.0 |
0.900 |
4 |
0 |
0 |
0.145 |
11 |
14 |
|
B |
11 |
6 |
13803 |
f |
[SO4]B:405 |
-y,x-y,z |
2_555 |
5 |
1 |
184 |
89.8 |
-12.6 |
0.852 |
3 |
0 |
0 |
0.156 |
12 |
15 |
|
[SO4]B:404 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
13803 |
88.9 |
-11.3 |
0.900 |
3 |
0 |
0 |
0.142 |
13 |
16 |
|
[SO4]A:403 |
5 |
1 |
183 |
f |
A |
-y,x-y,z |
2_555 |
11 |
6 |
14170 |
88.5 |
-12.1 |
0.870 |
3 |
0 |
0 |
0.141 |
14 |
17 |
|
[SO4]B:403 |
5 |
1 |
181 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
14170 |
87.7 |
-10.7 |
0.704 |
1 |
0 |
0 |
0.116 |
15 |
18 |
|
[SO4]B:403 |
5 |
1 |
181 |
◊ |
B |
x,y,z |
1_555 |
14 |
5 |
13803 |
85.1 |
-10.2 |
0.700 |
1 |
0 |
0 |
0.059 |
16 |
19 |
|
[SO4]B:406 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
13803 |
81.3 |
-11.9 |
0.735 |
2 |
0 |
0 |
0.144 |
17 |
20 |
|
[EDO]A:410 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
16 |
4 |
13803 |
80.2 |
1.8 |
0.351 |
0 |
0 |
0 |
0.000 |
18 |
21 |
|
[SO4]A:407 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
13803 |
79.2 |
-10.3 |
0.870 |
3 |
0 |
0 |
0.131 |
19 |
22 |
|
[SO4]A:406 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
14170 |
78.1 |
-11.7 |
0.629 |
2 |
0 |
0 |
0.132 |
20 |
23 |
|
[EDO]A:409 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
15 |
4 |
14170 |
77.5 |
1.8 |
0.352 |
0 |
0 |
0 |
0.000 |
21 |
24 |
|
[SO4]A:405 |
5 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
12 |
3 |
14170 |
74.0 |
-9.6 |
0.882 |
4 |
0 |
0 |
0.120 |
22 |
25 |
|
[SO4]A:407 |
5 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
9 |
5 |
14170 |
72.8 |
-9.3 |
0.888 |
4 |
0 |
0 |
0.061 |
23 |
26 |
|
[SO4]A:405 |
5 |
1 |
182 |
◊ |
B |
x-y,x,z-1/2 |
6_554 |
11 |
4 |
13803 |
71.8 |
-9.0 |
0.888 |
5 |
0 |
0 |
0.058 |
24 |
27 |
|
[SO4]B:405 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
8 |
2 |
13803 |
54.8 |
-5.6 |
0.890 |
1 |
0 |
0 |
0.068 |
25 |
28 |
|
[SO4]A:403 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
14170 |
53.7 |
-5.9 |
0.879 |
1 |
0 |
0 |
0.067 |
26 |
29 |
|
[PG4]A:411 |
7 |
1 |
412 |
f |
[AR6]A:401 |
x,y,z |
1_555 |
5 |
1 |
727 |
42.0 |
-1.2 |
0.186 |
0 |
0 |
0 |
0.012 |
27 |
30 |
|
[EDO]A:410 |
2 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
6 |
2 |
14170 |
38.6 |
0.9 |
0.516 |
0 |
0 |
0 |
0.000 |
28 |
31 |
|
[AR6]A:401 |
4 |
1 |
727 |
◊ |
B |
x,y,z |
1_555 |
7 |
2 |
13803 |
37.4 |
0.8 |
0.767 |
1 |
0 |
0 |
0.000 |
32 |
|
[AR6]B:401 |
4 |
1 |
729 |
◊ |
A |
x,y,z |
1_555 |
7 |
2 |
14170 |
34.8 |
0.7 |
0.753 |
1 |
0 |
0 |
0.000 |
Average: |
36.1 |
0.8 |
0.760 |
1 |
0 |
0 |
0.000 |
29 |
33 |
|
[EDO]A:409 |
3 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
13803 |
34.9 |
0.7 |
0.710 |
0 |
0 |
0 |
0.000 |
30 |
34 |
|
[PGE]B:408 |
5 |
1 |
336 |
f |
[AR6]B:401 |
x,y,z |
1_555 |
4 |
1 |
729 |
33.4 |
-1.2 |
0.127 |
1 |
0 |
0 |
0.018 |
31 |
35 |
|
[EDO]A:409 |
2 |
1 |
185 |
f |
[QUE]A:408 |
x,y,z |
1_555 |
6 |
1 |
450 |
9.1 |
0.4 |
0.891 |
0 |
0 |
0 |
0.000 |
|