## |
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 |
161 |
39 |
12127 |
◊ |
A |
x,-y+1,-z+1 |
4_566 |
166 |
41 |
12518 |
1577.7 |
-30.0 |
0.005 |
14 |
6 |
0 |
0.264 |
2 |
2 |
|
B |
154 |
43 |
12127 |
◊ |
A |
x,y,z |
1_555 |
157 |
45 |
12518 |
1492.9 |
-21.1 |
0.061 |
17 |
12 |
0 |
0.228 |
3 |
3 |
|
[NAP]B:300 |
47 |
1 |
895 |
f |
B |
x,y,z |
1_555 |
91 |
34 |
12127 |
643.8 |
-3.8 |
0.608 |
20 |
0 |
0 |
0.162 |
4 |
|
[NAP]A:300 |
48 |
1 |
875 |
f |
A |
x,y,z |
1_555 |
89 |
33 |
12518 |
610.4 |
-2.8 |
0.631 |
14 |
0 |
0 |
0.162 |
Average: |
627.1 |
-3.3 |
0.619 |
17 |
0 |
0 |
0.162 |
4 |
5 |
|
A |
61 |
20 |
12518 |
◊ |
B |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
62 |
22 |
12127 |
533.4 |
2.0 |
0.873 |
7 |
1 |
0 |
0.000 |
5 |
6 |
|
B |
30 |
9 |
12127 |
◊ |
B |
-x,y,-z+1/2 |
3_555 |
30 |
9 |
12127 |
280.0 |
-0.5 |
0.671 |
4 |
0 |
0 |
0.000 |
6 |
7 |
|
A |
13 |
5 |
12518 |
◊ |
A |
x,-y+1,-z+1 |
4_566 |
13 |
5 |
12518 |
133.8 |
-3.6 |
0.083 |
3 |
0 |
0 |
0.020 |
8 |
|
B |
10 |
4 |
12127 |
◊ |
B |
x,-y+1,-z+1 |
4_566 |
10 |
4 |
12127 |
102.4 |
-1.3 |
0.343 |
2 |
0 |
0 |
0.020 |
Average: |
118.1 |
-2.5 |
0.213 |
3 |
0 |
0 |
0.020 |
7 |
9 |
|
A |
17 |
6 |
12518 |
◊ |
[MES]B:401 |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
10 |
1 |
339 |
125.1 |
4.0 |
0.143 |
0 |
0 |
0 |
0.000 |
8 |
10 |
|
B |
13 |
6 |
12127 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
10 |
4 |
12518 |
108.2 |
0.2 |
0.699 |
1 |
0 |
0 |
0.000 |
9 |
11 |
|
B |
12 |
4 |
12127 |
◊ |
A |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
12 |
2 |
12518 |
97.8 |
-0.8 |
0.521 |
0 |
0 |
0 |
0.000 |
10 |
12 |
|
[MES]B:401 |
8 |
1 |
339 |
f |
B |
x,y,z |
1_555 |
16 |
5 |
12127 |
96.0 |
1.4 |
0.058 |
0 |
0 |
0 |
0.000 |
11 |
13 |
|
[CL]A:293 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
12518 |
81.1 |
-10.6 |
0.000 |
0 |
0 |
0 |
0.137 |
14 |
|
[CL]B:294 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
15 |
7 |
12127 |
64.1 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.137 |
Average: |
72.6 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.137 |
12 |
15 |
|
[SO4]A:404 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
12518 |
78.6 |
-9.9 |
0.843 |
5 |
0 |
0 |
0.090 |
13 |
16 |
|
[SO4]A:402 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
16 |
5 |
12518 |
76.2 |
-11.7 |
0.651 |
1 |
0 |
0 |
0.090 |
14 |
17 |
|
[CL]B:291 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
12127 |
66.8 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.069 |
15 |
18 |
|
[SO4]B:403 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
12127 |
66.6 |
-8.7 |
0.898 |
6 |
0 |
0 |
0.085 |
16 |
19 |
|
[SO4]A:404 |
5 |
1 |
184 |
f |
[NAP]A:300 |
x,y,z |
1_555 |
10 |
1 |
875 |
63.9 |
-10.8 |
0.625 |
0 |
0 |
0 |
0.081 |
17 |
20 |
|
[CL]A:292 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
12518 |
60.8 |
-8.5 |
0.000 |
0 |
0 |
0 |
0.064 |
18 |
21 |
|
[CL]A:292 |
1 |
1 |
125 |
◊ |
[MES]B:401 |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
5 |
1 |
339 |
26.5 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.000 |
19 |
22 |
|
B |
2 |
1 |
12127 |
◊ |
A |
-x,-y+1,z-1/2 |
2_564 |
1 |
1 |
12518 |
16.3 |
-0.1 |
0.339 |
0 |
0 |
0 |
0.000 |
20 |
23 |
|
[CL]A:292 |
1 |
1 |
125 |
◊ |
B |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
2 |
1 |
12127 |
10.9 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.000 |
21 |
24 |
|
[NAP]A:300 |
1 |
1 |
875 |
f |
[CL]A:293 |
x,y,z |
1_555 |
1 |
1 |
125 |
4.6 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.005 |
|