## |
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 |
|
A |
63 |
21 |
10656 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
62 |
23 |
10623 |
589.1 |
-2.1 |
0.453 |
4 |
0 |
0 |
0.000 |
2 |
2 |
|
A |
40 |
10 |
10656 |
◊ |
B |
x-1,y,z |
1_455 |
41 |
12 |
10623 |
341.2 |
1.2 |
0.713 |
4 |
5 |
0 |
0.000 |
3 |
3 |
|
A |
41 |
13 |
10656 |
x |
A |
x,y,z-1 |
1_554 |
32 |
9 |
10656 |
305.1 |
-0.8 |
0.490 |
0 |
0 |
0 |
0.000 |
4 |
4 |
|
A |
37 |
13 |
10656 |
◊ |
B |
x-1,y,z+1 |
1_456 |
31 |
12 |
10623 |
300.0 |
0.8 |
0.650 |
2 |
1 |
0 |
0.000 |
5 |
5 |
|
[1CE]B:2 |
20 |
1 |
451 |
f |
B |
x,y,z |
1_555 |
38 |
14 |
10623 |
231.1 |
1.2 |
0.622 |
2 |
0 |
0 |
0.003 |
6 |
|
[1CE]A:1 |
20 |
1 |
451 |
f |
A |
x,y,z |
1_555 |
38 |
14 |
10656 |
220.4 |
1.0 |
0.596 |
3 |
0 |
0 |
0.003 |
Average: |
225.7 |
1.1 |
0.609 |
3 |
0 |
0 |
0.003 |
6 |
7 |
|
A |
28 |
11 |
10656 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
28 |
9 |
10623 |
226.8 |
2.2 |
0.821 |
4 |
0 |
0 |
0.000 |
7 |
8 |
|
[1CE]B:3 |
17 |
1 |
447 |
f |
B |
x,y,z |
1_555 |
31 |
10 |
10623 |
191.1 |
-0.7 |
0.462 |
2 |
0 |
0 |
0.014 |
8 |
9 |
|
A |
24 |
7 |
10656 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
21 |
7 |
10623 |
187.5 |
-1.3 |
0.406 |
4 |
0 |
0 |
0.000 |
9 |
10 |
|
B |
23 |
9 |
10623 |
◊ |
A |
x,y,z-1 |
1_554 |
22 |
11 |
10656 |
179.8 |
-0.5 |
0.516 |
1 |
0 |
0 |
0.000 |
10 |
11 |
|
B |
20 |
6 |
10623 |
x |
B |
x-1,y,z-1 |
1_454 |
15 |
6 |
10623 |
136.7 |
0.2 |
0.627 |
2 |
1 |
0 |
0.000 |
11 |
12 |
|
A |
16 |
7 |
10656 |
◊ |
[1CE]B:3 |
x-1,y,z+1 |
1_456 |
15 |
1 |
447 |
124.2 |
-0.9 |
0.331 |
0 |
0 |
0 |
0.000 |
12 |
13 |
|
[DMS]B:8 |
4 |
1 |
214 |
◊ |
B |
x,y,z |
1_555 |
19 |
7 |
10623 |
123.7 |
2.8 |
0.542 |
1 |
0 |
0 |
0.000 |
14 |
|
[DMS]A:9 |
4 |
1 |
213 |
◊ |
A |
x,y,z |
1_555 |
20 |
7 |
10656 |
120.8 |
2.8 |
0.545 |
1 |
0 |
0 |
0.000 |
Average: |
122.2 |
2.8 |
0.543 |
1 |
0 |
0 |
0.000 |
13 |
15 |
|
B |
19 |
8 |
10623 |
x |
B |
x-1,y,z |
1_455 |
15 |
6 |
10623 |
121.5 |
-2.1 |
0.252 |
0 |
0 |
0 |
0.000 |
16 |
|
A |
16 |
8 |
10656 |
x |
A |
x-1,y,z |
1_455 |
15 |
6 |
10656 |
116.3 |
-1.8 |
0.261 |
0 |
0 |
0 |
0.000 |
Average: |
118.9 |
-1.9 |
0.257 |
0 |
0 |
0 |
0.000 |
14 |
17 |
|
A |
15 |
5 |
10656 |
◊ |
[1CE]B:4 |
-x+1,y-1/2,-z |
2_645 |
9 |
1 |
449 |
113.0 |
2.1 |
0.761 |
2 |
0 |
0 |
0.000 |
15 |
18 |
|
[1CE]B:4 |
18 |
1 |
449 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
10623 |
109.6 |
-1.7 |
0.173 |
0 |
0 |
0 |
0.014 |
16 |
19 |
|
[DMS]B:7 |
4 |
1 |
214 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
10623 |
88.2 |
1.7 |
0.340 |
2 |
0 |
0 |
0.000 |
17 |
20 |
|
B |
10 |
3 |
10623 |
x |
B |
x,y,z-1 |
1_554 |
10 |
4 |
10623 |
84.3 |
-0.2 |
0.488 |
0 |
0 |
0 |
0.000 |
18 |
21 |
|
[PO4]B:5 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
20 |
7 |
10623 |
77.4 |
-4.9 |
0.629 |
4 |
0 |
0 |
0.056 |
19 |
22 |
|
A |
13 |
4 |
10656 |
◊ |
[DMS]B:7 |
x-1,y,z |
1_455 |
3 |
1 |
214 |
74.8 |
1.9 |
0.520 |
0 |
0 |
0 |
0.000 |
20 |
23 |
|
[PO4]A:6 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
10656 |
74.4 |
-4.8 |
0.623 |
4 |
0 |
0 |
0.067 |
21 |
24 |
|
[PO4]B:5 |
5 |
1 |
188 |
f |
[1CE]B:2 |
x,y,z |
1_555 |
9 |
1 |
451 |
68.6 |
-4.1 |
0.616 |
0 |
0 |
0 |
0.035 |
22 |
25 |
|
[PO4]A:6 |
5 |
1 |
188 |
f |
[1CE]A:1 |
x,y,z |
1_555 |
9 |
1 |
451 |
68.3 |
-4.0 |
0.682 |
0 |
0 |
0 |
0.041 |
23 |
26 |
|
B |
10 |
4 |
10623 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
10656 |
67.9 |
1.4 |
0.837 |
0 |
0 |
0 |
0.000 |
24 |
27 |
|
A |
8 |
3 |
10656 |
◊ |
[1CE]B:4 |
-x,y-1/2,-z |
2_545 |
6 |
1 |
449 |
62.5 |
-1.2 |
0.254 |
0 |
0 |
0 |
0.000 |
25 |
28 |
|
[1CE]A:1 |
11 |
1 |
451 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
3 |
1 |
10623 |
55.0 |
-0.8 |
0.239 |
0 |
0 |
0 |
0.000 |
29 |
|
A |
3 |
1 |
10656 |
◊ |
[1CE]B:2 |
-x+1,y-1/2,-z |
2_645 |
11 |
1 |
451 |
49.1 |
-1.1 |
0.181 |
0 |
0 |
0 |
0.000 |
Average: |
52.1 |
-0.9 |
0.210 |
0 |
0 |
0 |
0.000 |
26 |
30 |
|
A |
2 |
1 |
10656 |
◊ |
[1CE]B:3 |
x-1,y,z |
1_455 |
5 |
1 |
447 |
37.5 |
0.7 |
0.670 |
0 |
0 |
0 |
0.000 |
27 |
31 |
|
A |
1 |
1 |
10656 |
◊ |
B |
-x+2,y-1/2,-z |
2_745 |
3 |
1 |
10623 |
28.3 |
0.6 |
0.865 |
1 |
0 |
0 |
0.000 |
28 |
32 |
|
[DMS]A:9 |
1 |
1 |
213 |
f |
B |
-x+1,y-1/2,-z |
2_645 |
3 |
1 |
10623 |
28.0 |
1.1 |
0.611 |
0 |
0 |
0 |
0.000 |
33 |
|
A |
3 |
1 |
10656 |
f |
[DMS]B:8 |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
214 |
26.4 |
1.0 |
0.610 |
0 |
0 |
0 |
0.000 |
Average: |
27.2 |
1.1 |
0.611 |
0 |
0 |
0 |
0.000 |
29 |
34 |
|
[PO4]A:6 |
1 |
1 |
188 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
10623 |
6.8 |
-0.4 |
0.425 |
0 |
0 |
0 |
0.000 |
|