## |
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 |
88 |
28 |
13340 |
◊ |
A |
x,y,z |
1_555 |
89 |
27 |
13215 |
832.9 |
-9.8 |
0.162 |
6 |
2 |
0 |
0.000 |
2 |
2 |
|
A |
80 |
25 |
13215 |
◊ |
B |
-x+1/2,y-1/2,-z |
3_545 |
74 |
15 |
13340 |
733.2 |
-7.3 |
0.247 |
4 |
3 |
0 |
0.096 |
3 |
3 |
|
B |
44 |
15 |
13340 |
x |
B |
x,y,z-1 |
1_554 |
50 |
18 |
13340 |
402.3 |
-2.3 |
0.434 |
2 |
0 |
0 |
0.000 |
4 |
|
A |
47 |
19 |
13215 |
x |
A |
x,y,z-1 |
1_554 |
34 |
11 |
13215 |
375.6 |
-1.0 |
0.591 |
3 |
0 |
0 |
0.000 |
Average: |
389.0 |
-1.6 |
0.512 |
3 |
0 |
0 |
0.000 |
4 |
5 |
|
A |
31 |
8 |
13215 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
34 |
13 |
13340 |
288.0 |
-0.2 |
0.614 |
3 |
1 |
0 |
0.000 |
5 |
6 |
|
A |
27 |
6 |
13215 |
◊ |
A |
-x,-y,z |
2_555 |
27 |
6 |
13215 |
213.6 |
-2.9 |
0.333 |
0 |
0 |
0 |
0.000 |
6 |
7 |
|
[CX5]B:301 |
16 |
1 |
423 |
◊ |
B |
x,y,z |
1_555 |
27 |
9 |
13340 |
184.1 |
2.6 |
0.332 |
0 |
0 |
0 |
0.000 |
7 |
8 |
|
[CX5]B:301 |
18 |
1 |
423 |
f |
A |
x,y,z |
1_555 |
25 |
10 |
13215 |
164.5 |
1.5 |
0.208 |
1 |
0 |
0 |
0.000 |
8 |
9 |
|
B |
17 |
5 |
13340 |
x |
B |
x-1/2,-y+1/2,-z |
4_455 |
13 |
3 |
13340 |
125.6 |
-1.6 |
0.364 |
0 |
1 |
0 |
0.000 |
9 |
10 |
|
[GOL]B:306 |
6 |
1 |
213 |
f |
B |
x,y,z |
1_555 |
16 |
8 |
13340 |
107.9 |
1.0 |
0.696 |
6 |
0 |
0 |
0.016 |
10 |
11 |
|
[SO4]A:302 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
16 |
9 |
13215 |
107.1 |
-14.9 |
0.862 |
6 |
0 |
0 |
0.348 |
12 |
|
[SO4]B:304 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
19 |
9 |
13340 |
106.0 |
-14.9 |
0.850 |
5 |
0 |
0 |
0.348 |
Average: |
106.5 |
-14.9 |
0.856 |
6 |
0 |
0 |
0.348 |
11 |
13 |
|
[GOL]A:303 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
14 |
4 |
13215 |
101.7 |
1.5 |
0.799 |
5 |
0 |
0 |
0.008 |
12 |
14 |
|
[GOL]B:305 |
6 |
1 |
217 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
13340 |
100.5 |
1.1 |
0.701 |
5 |
0 |
0 |
0.012 |
13 |
15 |
|
[SO4]B:307 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
13340 |
73.4 |
-10.4 |
0.738 |
2 |
0 |
0 |
0.114 |
14 |
16 |
|
[SO4]B:303 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
13340 |
62.1 |
-7.3 |
0.886 |
2 |
0 |
0 |
0.082 |
15 |
17 |
|
A |
7 |
3 |
13215 |
f |
[SO4]A:304 |
x,y,z-1 |
1_554 |
4 |
1 |
185 |
60.3 |
-6.9 |
0.862 |
1 |
0 |
0 |
0.073 |
16 |
18 |
|
[CL]A:305 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
13215 |
56.0 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.074 |
17 |
19 |
|
[CL]B:309 |
1 |
1 |
125 |
f |
A |
-x+1,-y,z |
2_655 |
7 |
4 |
13215 |
55.2 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.067 |
18 |
20 |
|
[CL]B:308 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
13340 |
49.0 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.054 |
19 |
21 |
|
A |
4 |
2 |
13215 |
◊ |
B |
-x+1/2,y-1/2,-z+1 |
3_546 |
3 |
2 |
13340 |
38.4 |
0.7 |
0.817 |
1 |
2 |
0 |
0.000 |
20 |
22 |
|
A |
2 |
1 |
13215 |
◊ |
[SO4]B:303 |
-x+1/2,y-1/2,-z |
3_545 |
4 |
1 |
185 |
35.7 |
-3.0 |
0.969 |
1 |
0 |
0 |
0.035 |
21 |
23 |
|
[SO4]A:304 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
13215 |
31.5 |
-2.8 |
0.937 |
1 |
0 |
0 |
0.000 |
22 |
24 |
|
[CL]B:309 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
13340 |
28.0 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.000 |
23 |
25 |
|
[CL]B:308 |
1 |
1 |
125 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
2 |
1 |
13340 |
17.1 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.000 |
24 |
26 |
|
A |
4 |
3 |
13215 |
◊ |
[SO4]B:307 |
-x+1/2,y-1/2,-z |
3_545 |
3 |
1 |
185 |
12.6 |
-1.7 |
0.677 |
0 |
0 |
0 |
0.017 |
25 |
27 |
|
[GOL]B:305 |
2 |
1 |
217 |
f |
[SO4]B:304 |
x,y,z |
1_555 |
1 |
1 |
185 |
8.9 |
-1.1 |
0.683 |
0 |
0 |
0 |
0.011 |
26 |
28 |
|
B |
2 |
1 |
13340 |
◊ |
A |
-x+1,-y,z |
2_655 |
1 |
1 |
13215 |
8.0 |
0.1 |
0.732 |
0 |
0 |
0 |
0.000 |
27 |
29 |
|
[GOL]A:303 |
1 |
1 |
220 |
f |
[SO4]A:302 |
x,y,z |
1_555 |
1 |
1 |
184 |
4.5 |
-0.5 |
0.632 |
0 |
0 |
0 |
0.005 |
|