| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
B |
186 |
56 |
11506 |
◊ |
A |
x,y,z |
1_555 |
189 |
50 |
12057 |
1715.2 |
-24.2 |
0.043 |
11 |
1 |
0 |
0.624 |
2 |
|
L |
177 |
49 |
11561 |
◊ |
H |
x,y,z |
1_555 |
158 |
43 |
11257 |
1549.4 |
-27.1 |
0.014 |
8 |
2 |
0 |
0.990 |
3 |
|
B |
76 |
22 |
11506 |
◊ |
B |
y-1,x+1,-z |
7_465 |
77 |
22 |
11506 |
640.2 |
-0.3 |
0.701 |
4 |
0 |
0 |
0.000 |
4 |
|
H |
48 |
11 |
11257 |
◊ |
H |
-y+3/2,-x+3/2,-z+1/2 |
16_665 |
49 |
11 |
11257 |
487.9 |
4.5 |
0.963 |
14 |
0 |
0 |
0.000 |
5 |
|
A |
52 |
17 |
12057 |
◊ |
L |
x,y,z |
1_555 |
57 |
22 |
11561 |
460.4 |
0.8 |
0.572 |
10 |
0 |
0 |
0.042 |
6 |
|
L |
48 |
15 |
11561 |
◊ |
L |
-x+1,-y+2,z |
2_675 |
48 |
15 |
11561 |
447.5 |
0.5 |
0.654 |
6 |
0 |
0 |
0.000 |
7 |
|
B |
50 |
14 |
11506 |
◊ |
L |
x,y,z |
1_555 |
47 |
16 |
11561 |
397.2 |
-3.5 |
0.332 |
4 |
3 |
0 |
0.066 |
8 |
|
A |
39 |
13 |
12057 |
◊ |
L |
-y+1,x+1,z |
3_665 |
30 |
10 |
11561 |
330.0 |
1.4 |
0.745 |
2 |
1 |
0 |
0.000 |
9 |
|
L |
23 |
10 |
11561 |
x |
L |
-y+1,x+1,z |
3_665 |
25 |
9 |
11561 |
215.3 |
-0.0 |
0.573 |
3 |
0 |
0 |
0.014 |
10 |
|
[P4S]L:301 |
21 |
1 |
554 |
◊ |
H |
x,y,z |
1_555 |
31 |
9 |
11257 |
210.8 |
1.6 |
0.374 |
1 |
0 |
0 |
0.000 |
11 |
|
L |
26 |
9 |
11561 |
f |
[P4S]H:301 |
-y+1,x+1,z |
3_665 |
18 |
1 |
551 |
193.2 |
0.3 |
0.228 |
1 |
0 |
0 |
0.010 |
12 |
|
[P4S]L:301 |
14 |
1 |
554 |
f |
L |
x,y,z |
1_555 |
24 |
7 |
11561 |
157.5 |
-0.9 |
0.186 |
1 |
0 |
0 |
0.090 |
13 |
|
B |
15 |
7 |
11506 |
◊ |
B |
x,-y+3,-z |
6_585 |
15 |
7 |
11506 |
141.8 |
2.6 |
0.895 |
2 |
4 |
0 |
0.000 |
14 |
|
B |
14 |
4 |
11506 |
◊ |
L |
-y+1,x+1,z |
3_665 |
15 |
6 |
11561 |
129.4 |
0.4 |
0.675 |
3 |
0 |
0 |
0.010 |
15 |
|
[P4S]H:301 |
8 |
1 |
551 |
◊ |
H |
x,y,z |
1_555 |
16 |
6 |
11257 |
126.7 |
0.3 |
0.401 |
1 |
0 |
0 |
0.001 |
16 |
|
B |
14 |
5 |
11506 |
◊ |
A |
y-1,x+1,-z |
7_465 |
9 |
3 |
12057 |
112.1 |
0.3 |
0.650 |
0 |
0 |
0 |
0.000 |
17 |
|
H |
11 |
5 |
11257 |
◊ |
H |
y-1/2,x+1/2,-z+1/2 |
15_455 |
11 |
5 |
11257 |
99.6 |
1.1 |
0.843 |
0 |
0 |
0 |
0.000 |
18 |
|
[SO4]A:301 |
5 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
12057 |
97.6 |
-15.3 |
0.709 |
5 |
0 |
0 |
0.376 |
19 |
|
[P4S]L:301 |
10 |
1 |
554 |
◊ |
[P4S]H:301 |
x,y,z |
1_555 |
7 |
1 |
551 |
76.8 |
1.4 |
0.273 |
0 |
0 |
0 |
0.000 |
20 |
|
L |
7 |
2 |
11561 |
◊ |
H |
-y+3/2,-x+3/2,-z+1/2 |
16_665 |
12 |
7 |
11257 |
74.5 |
1.4 |
0.835 |
2 |
0 |
0 |
0.000 |
21 |
|
[P4S]H:301 |
8 |
1 |
551 |
◊ |
L |
x,y,z |
1_555 |
10 |
3 |
11561 |
69.8 |
1.6 |
0.482 |
0 |
0 |
0 |
0.000 |
22 |
|
L |
7 |
2 |
11561 |
◊ |
[P4S]L:301 |
-y+1,x+1,z |
3_665 |
7 |
1 |
554 |
62.4 |
1.3 |
0.536 |
1 |
0 |
0 |
0.000 |
23 |
|
A |
8 |
2 |
12057 |
◊ |
H |
x,y,z |
1_555 |
8 |
2 |
11257 |
62.4 |
-0.5 |
0.560 |
0 |
0 |
0 |
0.006 |
24 |
|
L |
10 |
4 |
11561 |
◊ |
H |
-y+1,x+1,z |
3_665 |
5 |
3 |
11257 |
55.2 |
-0.6 |
0.365 |
0 |
0 |
0 |
0.006 |
25 |
|
[SO4]A:301 |
3 |
1 |
183 |
◊ |
L |
-y+1,x+1,z |
3_665 |
7 |
4 |
11561 |
47.7 |
-6.0 |
0.714 |
0 |
0 |
0 |
0.065 |
26 |
|
L |
8 |
3 |
11561 |
◊ |
H |
-x+1,-y+2,z |
2_675 |
2 |
1 |
11257 |
33.2 |
-0.1 |
0.472 |
0 |
0 |
0 |
0.000 |
27 |
|
A |
2 |
1 |
12057 |
◊ |
[P4S]H:301 |
-y+1,x+1,z |
3_665 |
3 |
1 |
551 |
11.1 |
0.3 |
0.505 |
0 |
0 |
0 |
0.000 |
28 |
|
H |
1 |
1 |
11257 |
x |
H |
-y+1,x+1,z |
3_665 |
1 |
1 |
11257 |
0.8 |
-0.0 |
0.615 |
0 |
0 |
0 |
0.000 |
29 |
|
B |
1 |
1 |
11506 |
◊ |
A |
x,-y+3,-z |
6_585 |
1 |
1 |
12057 |
0.1 |
-0.0 |
0.635 |
0 |
0 |
0 |
0.000 |
|