## |
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 |
|
H |
178 |
52 |
11688 |
◊ |
L |
x,y,z |
1_555 |
199 |
54 |
10916 |
1648.6 |
-21.8 |
0.074 |
15 |
3 |
0 |
0.698 |
2 |
|
Y |
176 |
51 |
11615 |
◊ |
X |
x,y,z |
1_555 |
186 |
50 |
10760 |
1612.3 |
-23.2 |
0.069 |
14 |
1 |
0 |
0.698 |
Average: |
1630.4 |
-22.5 |
0.071 |
15 |
2 |
0 |
0.698 |
2 |
3 |
|
W |
126 |
31 |
6754 |
◊ |
V |
x,y,z |
1_555 |
128 |
31 |
6731 |
1313.1 |
-23.4 |
0.063 |
25 |
4 |
2 |
1.000 |
3 |
4 |
|
H |
96 |
22 |
11688 |
◊ |
W |
x,y,z |
1_555 |
83 |
19 |
6754 |
781.2 |
-5.1 |
0.617 |
18 |
0 |
0 |
0.437 |
5 |
|
Y |
90 |
22 |
11615 |
◊ |
V |
x,y,z |
1_555 |
76 |
19 |
6731 |
778.9 |
-5.0 |
0.626 |
18 |
0 |
0 |
0.437 |
Average: |
780.0 |
-5.1 |
0.622 |
18 |
0 |
0 |
0.437 |
4 |
6 |
|
X |
48 |
17 |
10760 |
◊ |
H |
-x+1,y-1/2,-z |
2_645 |
48 |
17 |
11688 |
431.8 |
-0.9 |
0.699 |
4 |
0 |
0 |
0.000 |
5 |
7 |
|
H |
44 |
12 |
11688 |
◊ |
L |
-x,y-1/2,-z+1 |
2_546 |
40 |
12 |
10916 |
374.9 |
-0.7 |
0.655 |
7 |
0 |
0 |
0.000 |
6 |
8 |
|
Y |
21 |
7 |
11615 |
◊ |
H |
-x,y-1/2,-z |
2_545 |
20 |
7 |
11688 |
192.9 |
-1.2 |
0.560 |
2 |
0 |
0 |
0.000 |
7 |
9 |
|
Y |
24 |
9 |
11615 |
◊ |
L |
-x,y-1/2,-z |
2_545 |
23 |
9 |
10916 |
179.2 |
-0.6 |
0.622 |
3 |
0 |
0 |
0.000 |
8 |
10 |
|
W |
19 |
6 |
6754 |
◊ |
L |
-x,y-1/2,-z |
2_545 |
19 |
7 |
10916 |
174.9 |
0.8 |
0.774 |
2 |
2 |
0 |
0.000 |
9 |
11 |
|
X |
19 |
8 |
10760 |
◊ |
V |
-x+1,y-1/2,-z |
2_645 |
17 |
7 |
6731 |
148.3 |
-1.3 |
0.483 |
0 |
0 |
0 |
0.000 |
10 |
12 |
|
Y |
12 |
3 |
11615 |
◊ |
X |
x,y-1,z |
1_545 |
13 |
6 |
10760 |
107.7 |
0.6 |
0.727 |
3 |
0 |
0 |
0.000 |
11 |
13 |
|
X |
11 |
5 |
10760 |
◊ |
V |
x,y,z |
1_555 |
12 |
3 |
6731 |
101.7 |
-0.6 |
0.422 |
1 |
0 |
0 |
0.016 |
14 |
|
L |
11 |
5 |
10916 |
◊ |
W |
x,y,z |
1_555 |
10 |
2 |
6754 |
95.5 |
-0.7 |
0.401 |
0 |
0 |
0 |
0.016 |
Average: |
98.6 |
-0.6 |
0.411 |
1 |
0 |
0 |
0.016 |
12 |
15 |
|
Y |
9 |
3 |
11615 |
◊ |
W |
x,y,z |
1_555 |
15 |
3 |
6754 |
91.9 |
-1.2 |
0.477 |
0 |
0 |
0 |
0.012 |
13 |
16 |
|
H |
10 |
3 |
11688 |
◊ |
V |
x,y,z |
1_555 |
14 |
4 |
6731 |
89.1 |
-1.0 |
0.505 |
0 |
0 |
0 |
0.009 |
14 |
17 |
|
[SO4]Y:992 |
5 |
1 |
183 |
f |
Y |
x,y,z |
1_555 |
13 |
5 |
11615 |
85.0 |
-12.6 |
0.805 |
2 |
0 |
0 |
0.436 |
15 |
18 |
|
[SO4]H:991 |
4 |
1 |
182 |
f |
H |
x,y,z |
1_555 |
12 |
5 |
11688 |
83.4 |
-11.2 |
0.847 |
3 |
0 |
0 |
0.417 |
16 |
19 |
|
X |
6 |
2 |
10760 |
◊ |
L |
-x,y-3/2,-z |
2_535 |
5 |
3 |
10916 |
44.6 |
0.4 |
0.496 |
0 |
0 |
0 |
0.000 |
17 |
20 |
|
H |
4 |
3 |
11688 |
x |
H |
-x,y-1/2,-z+1 |
2_546 |
4 |
2 |
11688 |
40.3 |
0.8 |
0.768 |
1 |
0 |
0 |
0.000 |
18 |
21 |
|
[SO4]Y:992 |
4 |
1 |
183 |
◊ |
V |
x,y,z |
1_555 |
4 |
2 |
6731 |
32.7 |
-4.5 |
0.532 |
0 |
0 |
0 |
0.145 |
19 |
22 |
|
[SO4]H:991 |
4 |
1 |
182 |
◊ |
W |
x,y,z |
1_555 |
2 |
2 |
6754 |
32.5 |
-4.4 |
0.417 |
0 |
0 |
0 |
0.146 |
20 |
23 |
|
Y |
4 |
2 |
11615 |
x |
Y |
x,y-1,z |
1_545 |
1 |
1 |
11615 |
16.8 |
-0.2 |
0.328 |
0 |
0 |
0 |
0.000 |
21 |
24 |
|
L |
3 |
1 |
10916 |
x |
L |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
10916 |
7.7 |
0.1 |
0.717 |
0 |
0 |
0 |
0.000 |
22 |
25 |
|
Y |
1 |
1 |
11615 |
◊ |
L |
-x,y-3/2,-z |
2_535 |
1 |
1 |
10916 |
0.3 |
0.0 |
0.643 |
0 |
0 |
0 |
0.000 |
|