## |
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 |
137 |
34 |
14279 |
◊ |
A |
x,y,z |
1_555 |
130 |
32 |
14375 |
1126.6 |
-3.6 |
0.446 |
7 |
1 |
0 |
0.000 |
2 |
2 |
|
[NDP]B:501 |
47 |
1 |
913 |
f |
B |
x,y,z |
1_555 |
82 |
31 |
14279 |
629.7 |
-2.6 |
0.473 |
19 |
0 |
0 |
0.300 |
3 |
|
[NDP]A:501 |
46 |
1 |
916 |
f |
A |
x,y,z |
1_555 |
81 |
30 |
14375 |
620.0 |
-2.4 |
0.491 |
17 |
0 |
0 |
0.300 |
Average: |
624.9 |
-2.5 |
0.482 |
18 |
0 |
0 |
0.300 |
3 |
4 |
|
A |
50 |
14 |
14375 |
◊ |
A |
x-y+1/3,-y+2/3,-z+5/3 |
17_556 |
50 |
14 |
14375 |
495.7 |
-3.4 |
0.354 |
4 |
2 |
0 |
0.083 |
4 |
5 |
|
B |
47 |
12 |
14279 |
x |
B |
-y+1,x-y,z |
2_655 |
49 |
16 |
14279 |
411.7 |
-3.3 |
0.240 |
3 |
2 |
0 |
0.119 |
5 |
6 |
|
B |
41 |
12 |
14279 |
◊ |
A |
-y+2/3,x-y-2/3,z+1/3 |
8_545 |
41 |
13 |
14375 |
374.6 |
-0.7 |
0.493 |
3 |
1 |
0 |
0.000 |
6 |
7 |
|
B |
36 |
12 |
14279 |
◊ |
A |
-x+y+5/3,-x+4/3,z+1/3 |
9_665 |
21 |
6 |
14375 |
206.9 |
-0.4 |
0.543 |
3 |
1 |
0 |
0.000 |
7 |
8 |
|
[EDO]A:606 |
4 |
1 |
181 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
14375 |
112.3 |
3.8 |
0.597 |
4 |
0 |
0 |
0.000 |
9 |
|
[EDO]B:602 |
4 |
1 |
179 |
f |
B |
x,y,z |
1_555 |
17 |
9 |
14279 |
111.7 |
3.8 |
0.601 |
5 |
0 |
0 |
0.000 |
Average: |
112.0 |
3.8 |
0.599 |
5 |
0 |
0 |
0.000 |
8 |
10 |
|
[EDO]A:604 |
4 |
1 |
180 |
f |
A |
x,y,z |
1_555 |
28 |
8 |
14375 |
108.1 |
2.3 |
0.380 |
0 |
0 |
0 |
0.000 |
9 |
11 |
|
[EDO]B:603 |
4 |
1 |
179 |
f |
B |
x,y,z |
1_555 |
28 |
8 |
14279 |
104.8 |
2.9 |
0.420 |
1 |
0 |
0 |
0.000 |
10 |
12 |
|
[EDO]B:601 |
4 |
1 |
181 |
◊ |
B |
x,y,z |
1_555 |
15 |
6 |
14279 |
94.8 |
2.8 |
0.280 |
2 |
0 |
0 |
0.000 |
11 |
13 |
|
B |
11 |
3 |
14279 |
◊ |
A |
-x+2,-x+y+1,-z+2 |
6_767 |
10 |
5 |
14375 |
93.5 |
0.7 |
0.680 |
0 |
0 |
0 |
0.000 |
12 |
14 |
|
[EDO]A:605 |
4 |
1 |
179 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
14375 |
75.1 |
2.4 |
0.890 |
5 |
0 |
0 |
0.000 |
13 |
15 |
|
[SO4]A:401 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
12 |
6 |
14375 |
74.9 |
-9.8 |
0.909 |
2 |
0 |
0 |
0.324 |
14 |
16 |
|
[SO4]B:404 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
14279 |
71.0 |
-10.0 |
0.717 |
1 |
0 |
0 |
0.253 |
15 |
17 |
|
[EDO]B:601 |
3 |
1 |
181 |
f |
B |
-y+1,x-y,z |
2_655 |
10 |
5 |
14279 |
55.4 |
1.5 |
0.270 |
1 |
0 |
0 |
0.000 |
16 |
18 |
|
B |
8 |
3 |
14279 |
◊ |
B |
-x+2,-x+y+1,-z+2 |
6_767 |
8 |
3 |
14279 |
49.9 |
-0.4 |
0.494 |
0 |
0 |
0 |
0.000 |
17 |
19 |
|
[SO4]B:402 |
5 |
1 |
184 |
fx |
[SO4]B:402 |
-y+1,x-y,z |
2_655 |
5 |
1 |
184 |
49.6 |
-10.5 |
0.993 |
0 |
0 |
0 |
0.253 |
18 |
20 |
|
[SO4]A:401 |
4 |
1 |
185 |
f |
[SO4]A:401 |
x-y+1/3,-y+2/3,-z+5/3 |
17_556 |
4 |
1 |
185 |
48.9 |
-11.5 |
0.998 |
0 |
0 |
0 |
0.174 |
19 |
21 |
|
[SO4]B:403 |
4 |
1 |
186 |
f |
A |
-x+2,-x+y+1,-z+2 |
6_767 |
6 |
2 |
14375 |
45.3 |
-4.3 |
0.928 |
2 |
0 |
0 |
0.157 |
20 |
22 |
|
[SO4]B:403 |
4 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
14279 |
42.3 |
-4.6 |
0.931 |
1 |
0 |
0 |
0.000 |
21 |
23 |
|
[EDO]A:604 |
3 |
1 |
180 |
f |
[NDP]A:501 |
x,y,z |
1_555 |
7 |
1 |
916 |
38.3 |
0.3 |
0.621 |
0 |
0 |
0 |
0.000 |
22 |
24 |
|
[EDO]B:603 |
4 |
1 |
179 |
f |
[NDP]B:501 |
x,y,z |
1_555 |
3 |
1 |
913 |
34.7 |
-0.1 |
0.526 |
0 |
0 |
0 |
0.001 |
23 |
25 |
|
B |
6 |
3 |
14279 |
◊ |
[SO4]B:402 |
-y+1,x-y,z |
2_655 |
3 |
1 |
184 |
29.9 |
-3.5 |
0.892 |
2 |
0 |
0 |
0.106 |
24 |
26 |
|
[SO4]A:401 |
3 |
1 |
185 |
◊ |
A |
x-y+1/3,-y+2/3,-z+5/3 |
17_556 |
5 |
2 |
14375 |
28.2 |
-3.2 |
0.956 |
1 |
0 |
0 |
0.109 |
25 |
27 |
|
[SO4]B:402 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
14279 |
25.0 |
-2.4 |
0.958 |
3 |
0 |
0 |
0.090 |
26 |
28 |
|
[SO4]B:402 |
4 |
1 |
184 |
◊ |
B |
-y+1,x-y,z |
2_655 |
4 |
3 |
14279 |
23.0 |
-2.5 |
0.961 |
2 |
0 |
0 |
0.081 |
27 |
29 |
|
B |
1 |
1 |
14279 |
◊ |
A |
x-y,-y,-z+2 |
5_557 |
2 |
2 |
14375 |
11.3 |
0.1 |
0.380 |
0 |
0 |
0 |
0.000 |
28 |
30 |
|
B |
1 |
1 |
14279 |
◊ |
[EDO]A:605 |
-y+2/3,x-y-2/3,z+1/3 |
8_545 |
2 |
1 |
179 |
8.1 |
0.3 |
0.898 |
0 |
0 |
0 |
0.000 |
29 |
31 |
|
A |
3 |
1 |
14375 |
◊ |
A |
-x+4/3,-x+y+2/3,-z+5/3 |
18_656 |
3 |
1 |
14375 |
7.1 |
0.1 |
0.644 |
0 |
0 |
0 |
0.000 |
30 |
32 |
|
[NDP]B:501 |
1 |
1 |
913 |
◊ |
[SO4]B:403 |
x,y,z |
1_555 |
1 |
1 |
186 |
6.8 |
-0.7 |
0.678 |
0 |
0 |
0 |
0.000 |
|