## |
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 |
|
C |
146 |
36 |
7439 |
◊ |
B |
x,y,z |
1_555 |
146 |
35 |
7521 |
1433.7 |
-15.7 |
0.326 |
17 |
8 |
0 |
0.676 |
2 |
|
E |
143 |
35 |
7446 |
◊ |
D |
x,y,z |
1_555 |
144 |
36 |
7386 |
1428.8 |
-11.9 |
0.546 |
17 |
12 |
0 |
0.676 |
3 |
|
B |
142 |
35 |
7521 |
◊ |
A |
x,y,z |
1_555 |
146 |
36 |
7338 |
1428.0 |
-12.8 |
0.565 |
16 |
7 |
0 |
0.676 |
4 |
|
L |
143 |
35 |
7152 |
◊ |
J |
x,y,z |
1_555 |
143 |
34 |
7262 |
1412.6 |
-14.7 |
0.550 |
16 |
8 |
0 |
0.676 |
5 |
|
C |
142 |
35 |
7439 |
◊ |
A |
x,y,z |
1_555 |
146 |
37 |
7338 |
1411.4 |
-12.8 |
0.567 |
17 |
7 |
0 |
0.676 |
6 |
|
K |
146 |
36 |
7360 |
◊ |
J |
x,y,z |
1_555 |
145 |
34 |
7262 |
1410.6 |
-13.0 |
0.593 |
16 |
10 |
0 |
0.676 |
7 |
|
H |
143 |
35 |
7419 |
◊ |
G |
x,y,z |
1_555 |
145 |
35 |
7377 |
1410.2 |
-14.8 |
0.408 |
17 |
5 |
0 |
0.676 |
8 |
|
I |
141 |
35 |
7201 |
◊ |
G |
x,y,z |
1_555 |
146 |
35 |
7377 |
1409.2 |
-13.4 |
0.611 |
16 |
8 |
0 |
0.676 |
9 |
|
F |
147 |
35 |
7485 |
◊ |
D |
x,y,z |
1_555 |
143 |
34 |
7386 |
1406.4 |
-13.3 |
0.458 |
16 |
6 |
0 |
0.676 |
10 |
|
F |
138 |
34 |
7485 |
◊ |
E |
x,y,z |
1_555 |
145 |
35 |
7446 |
1392.0 |
-13.9 |
0.414 |
16 |
6 |
0 |
0.676 |
11 |
|
I |
141 |
37 |
7201 |
◊ |
H |
x,y,z |
1_555 |
137 |
34 |
7419 |
1387.4 |
-15.8 |
0.393 |
14 |
4 |
0 |
0.676 |
12 |
|
L |
137 |
36 |
7152 |
◊ |
K |
x,y,z |
1_555 |
142 |
34 |
7360 |
1379.9 |
-14.5 |
0.482 |
18 |
6 |
0 |
0.676 |
Average: |
1409.2 |
-13.9 |
0.493 |
16 |
7 |
0 |
0.676 |
2 |
13 |
|
I |
62 |
22 |
7201 |
◊ |
B |
x,y,z |
1_555 |
61 |
20 |
7521 |
563.6 |
-0.9 |
0.878 |
7 |
0 |
0 |
0.000 |
14 |
|
L |
63 |
21 |
7152 |
◊ |
E |
x,y,z |
1_555 |
62 |
19 |
7446 |
557.1 |
-0.7 |
0.880 |
7 |
0 |
0 |
0.000 |
15 |
|
F |
59 |
19 |
7485 |
◊ |
C |
x,y-1,z |
1_545 |
61 |
20 |
7439 |
530.3 |
-1.6 |
0.791 |
7 |
0 |
0 |
0.000 |
Average: |
550.3 |
-1.1 |
0.850 |
7 |
0 |
0 |
0.000 |
3 |
16 |
|
D |
23 |
10 |
7386 |
◊ |
G |
-x+1,y-1/2,-z+1/2 |
3_645 |
26 |
6 |
7377 |
227.1 |
-3.7 |
0.269 |
1 |
0 |
0 |
0.000 |
17 |
|
C |
24 |
6 |
7439 |
◊ |
H |
x-1/2,-y+3/2,-z+1 |
4_466 |
21 |
8 |
7419 |
206.1 |
-3.2 |
0.354 |
0 |
0 |
0 |
0.000 |
18 |
|
J |
23 |
6 |
7262 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
17 |
7 |
7338 |
205.7 |
-4.0 |
0.215 |
0 |
0 |
0 |
0.000 |
Average: |
213.0 |
-3.6 |
0.279 |
0 |
0 |
0 |
0.000 |
4 |
19 |
|
E |
19 |
6 |
7446 |
◊ |
B |
x,y,z |
1_555 |
16 |
5 |
7521 |
179.4 |
3.0 |
0.954 |
6 |
8 |
0 |
0.000 |
5 |
20 |
|
K |
17 |
5 |
7360 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
14 |
4 |
7521 |
143.7 |
-1.4 |
0.528 |
0 |
1 |
0 |
0.000 |
21 |
|
E |
15 |
4 |
7446 |
◊ |
H |
-x+1,y-1/2,-z+1/2 |
3_645 |
16 |
4 |
7419 |
140.1 |
-1.2 |
0.547 |
0 |
1 |
0 |
0.000 |
22 |
|
A |
15 |
4 |
7338 |
◊ |
I |
x-1/2,-y+3/2,-z+1 |
4_466 |
15 |
4 |
7201 |
135.6 |
-1.2 |
0.584 |
0 |
0 |
0 |
0.000 |
Average: |
139.8 |
-1.3 |
0.553 |
0 |
1 |
0 |
0.000 |
6 |
23 |
|
L |
18 |
8 |
7152 |
◊ |
F |
x-1/2,-y+1/2,-z+1 |
4_456 |
16 |
6 |
7485 |
141.2 |
-2.4 |
0.397 |
0 |
0 |
0 |
0.000 |
7 |
24 |
|
L |
19 |
5 |
7152 |
◊ |
E |
x-1,y,z |
1_455 |
17 |
5 |
7446 |
132.1 |
-0.6 |
0.702 |
0 |
0 |
0 |
0.000 |
25 |
|
B |
17 |
5 |
7521 |
◊ |
I |
x-1,y,z |
1_455 |
17 |
4 |
7201 |
125.8 |
-0.9 |
0.651 |
0 |
0 |
0 |
0.000 |
Average: |
129.0 |
-0.7 |
0.677 |
0 |
0 |
0 |
0.000 |
8 |
26 |
|
[PO4]H:201 |
5 |
1 |
188 |
f |
H |
x,y,z |
1_555 |
23 |
10 |
7419 |
125.4 |
-9.1 |
0.740 |
4 |
0 |
0 |
0.107 |
9 |
27 |
|
[PO4]K:201 |
5 |
1 |
189 |
f |
K |
x,y,z |
1_555 |
22 |
9 |
7360 |
121.9 |
-8.7 |
0.767 |
5 |
0 |
0 |
0.108 |
10 |
28 |
|
[PO4]C:201 |
5 |
1 |
188 |
f |
C |
x,y,z |
1_555 |
19 |
11 |
7439 |
121.5 |
-8.9 |
0.760 |
4 |
0 |
0 |
0.106 |
11 |
29 |
|
[PO4]E:202 |
5 |
1 |
188 |
f |
E |
x,y,z |
1_555 |
23 |
11 |
7446 |
121.4 |
-9.0 |
0.755 |
4 |
0 |
0 |
0.080 |
12 |
30 |
|
[PO4]A:201 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
21 |
11 |
7338 |
121.2 |
-8.9 |
0.770 |
4 |
0 |
0 |
0.107 |
13 |
31 |
|
[PO4]G:201 |
5 |
1 |
187 |
f |
G |
x,y,z |
1_555 |
24 |
10 |
7377 |
120.4 |
-8.9 |
0.768 |
4 |
0 |
0 |
0.106 |
14 |
32 |
|
[PO4]B:201 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
23 |
9 |
7521 |
119.9 |
-9.1 |
0.742 |
7 |
0 |
0 |
0.122 |
15 |
33 |
|
[PO4]J:201 |
5 |
1 |
189 |
f |
J |
x,y,z |
1_555 |
20 |
10 |
7262 |
118.4 |
-8.9 |
0.781 |
5 |
0 |
0 |
0.110 |
16 |
34 |
|
[PO4]D:201 |
5 |
1 |
188 |
f |
D |
x,y,z |
1_555 |
22 |
11 |
7386 |
117.7 |
-9.0 |
0.759 |
5 |
0 |
0 |
0.100 |
17 |
35 |
|
[PO4]F:202 |
5 |
1 |
190 |
cf |
F |
x,y,z |
1_555 |
22 |
10 |
7485 |
117.1 |
-8.6 |
0.757 |
4 |
0 |
0 |
0.077 |
18 |
36 |
|
[PO4]L:201 |
5 |
1 |
188 |
f |
L |
x,y,z |
1_555 |
19 |
10 |
7152 |
116.4 |
-8.9 |
0.782 |
4 |
0 |
0 |
0.106 |
19 |
37 |
|
[PO4]I:201 |
5 |
1 |
188 |
f |
I |
x,y,z |
1_555 |
21 |
10 |
7201 |
115.2 |
-9.0 |
0.779 |
8 |
0 |
0 |
0.123 |
20 |
38 |
|
[SO4]F:201 |
5 |
1 |
184 |
f |
F |
x,y,z |
1_555 |
9 |
4 |
7485 |
85.0 |
-12.3 |
0.893 |
6 |
0 |
0 |
0.111 |
21 |
39 |
|
[SO4]E:201 |
5 |
1 |
184 |
f |
E |
x,y,z |
1_555 |
8 |
6 |
7446 |
84.6 |
-18.7 |
0.719 |
4 |
0 |
0 |
0.152 |
22 |
40 |
|
F |
10 |
6 |
7485 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
7521 |
67.7 |
-0.5 |
0.546 |
1 |
0 |
0 |
0.000 |
41 |
|
E |
9 |
3 |
7446 |
◊ |
C |
x,y,z |
1_555 |
8 |
5 |
7439 |
62.7 |
-0.5 |
0.524 |
1 |
0 |
0 |
0.000 |
Average: |
65.2 |
-0.5 |
0.535 |
1 |
0 |
0 |
0.000 |
23 |
42 |
|
K |
11 |
5 |
7360 |
◊ |
G |
-x,y-1/2,-z+1/2 |
3_545 |
8 |
6 |
7377 |
66.5 |
-1.0 |
0.385 |
0 |
0 |
0 |
0.000 |
43 |
|
J |
6 |
4 |
7262 |
◊ |
H |
-x+1,y-1/2,-z+1/2 |
3_645 |
9 |
4 |
7419 |
58.6 |
-0.7 |
0.384 |
0 |
0 |
0 |
0.000 |
44 |
|
A |
5 |
4 |
7338 |
◊ |
C |
x-1/2,-y+3/2,-z+1 |
4_466 |
5 |
4 |
7439 |
20.6 |
-0.5 |
0.498 |
0 |
0 |
0 |
0.000 |
Average: |
48.6 |
-0.8 |
0.422 |
0 |
0 |
0 |
0.000 |
24 |
45 |
|
K |
11 |
6 |
7360 |
◊ |
D |
x-1,y,z |
1_455 |
12 |
5 |
7386 |
64.3 |
-0.6 |
0.605 |
0 |
0 |
0 |
0.000 |
46 |
|
A |
8 |
3 |
7338 |
◊ |
H |
x-1,y,z |
1_455 |
8 |
3 |
7419 |
49.5 |
-0.4 |
0.606 |
0 |
0 |
0 |
0.000 |
Average: |
56.9 |
-0.5 |
0.605 |
0 |
0 |
0 |
0.000 |
25 |
47 |
|
A |
7 |
3 |
7338 |
◊ |
H |
x-1/2,-y+3/2,-z+1 |
4_466 |
8 |
4 |
7419 |
50.9 |
-0.8 |
0.500 |
0 |
0 |
0 |
0.000 |
48 |
|
K |
7 |
3 |
7360 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
8 |
4 |
7338 |
50.0 |
-0.7 |
0.511 |
0 |
0 |
0 |
0.000 |
49 |
|
D |
6 |
2 |
7386 |
◊ |
H |
-x+1,y-1/2,-z+1/2 |
3_645 |
7 |
2 |
7419 |
46.4 |
-0.8 |
0.420 |
0 |
0 |
0 |
0.000 |
Average: |
49.1 |
-0.8 |
0.477 |
0 |
0 |
0 |
0.000 |
26 |
50 |
|
L |
4 |
2 |
7152 |
◊ |
[SO4]F:201 |
x-1/2,-y+1/2,-z+1 |
4_456 |
4 |
1 |
184 |
37.9 |
-5.4 |
0.513 |
0 |
0 |
0 |
0.000 |
27 |
51 |
|
L |
4 |
2 |
7152 |
◊ |
D |
x-1,y,z |
1_455 |
3 |
3 |
7386 |
28.6 |
-0.3 |
0.531 |
0 |
0 |
0 |
0.000 |
52 |
|
A |
2 |
2 |
7338 |
◊ |
I |
x-1,y,z |
1_455 |
2 |
1 |
7201 |
17.7 |
-0.3 |
0.430 |
0 |
0 |
0 |
0.000 |
53 |
|
B |
1 |
1 |
7521 |
◊ |
H |
x-1,y,z |
1_455 |
1 |
1 |
7419 |
0.9 |
-0.0 |
0.561 |
0 |
0 |
0 |
0.000 |
Average: |
15.7 |
-0.2 |
0.507 |
0 |
0 |
0 |
0.000 |
28 |
54 |
|
[SO4]E:201 |
1 |
1 |
184 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
7386 |
17.1 |
-2.5 |
0.437 |
0 |
0 |
0 |
0.018 |
29 |
55 |
|
K |
3 |
2 |
7360 |
◊ |
F |
x-1/2,-y+1/2,-z+1 |
4_456 |
4 |
2 |
7485 |
13.1 |
0.1 |
0.716 |
0 |
0 |
0 |
0.000 |
30 |
56 |
|
B |
1 |
1 |
7521 |
◊ |
D |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
7386 |
11.8 |
-0.0 |
0.418 |
0 |
0 |
0 |
0.000 |
31 |
57 |
|
K |
1 |
1 |
7360 |
◊ |
H |
x-1,y-1,z |
1_445 |
2 |
1 |
7419 |
7.2 |
-0.2 |
0.351 |
0 |
0 |
0 |
0.000 |
32 |
58 |
|
L |
2 |
2 |
7152 |
◊ |
I |
x-1,y,z |
1_455 |
2 |
2 |
7201 |
4.4 |
-0.1 |
0.516 |
0 |
0 |
0 |
0.000 |
33 |
59 |
|
K |
1 |
1 |
7360 |
◊ |
[SO4]F:201 |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
184 |
3.7 |
-0.4 |
0.862 |
0 |
0 |
0 |
0.000 |
34 |
60 |
|
E |
1 |
1 |
7446 |
◊ |
D |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
7386 |
2.2 |
-0.0 |
0.583 |
0 |
0 |
0 |
0.000 |
35 |
61 |
|
A |
1 |
1 |
7338 |
◊ |
F |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
7485 |
1.2 |
-0.0 |
0.605 |
0 |
0 |
0 |
0.000 |
|