| ## |
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 |
153 |
39 |
14156 |
◊ |
B |
x,y,z |
1_555 |
164 |
41 |
13985 |
1499.5 |
-18.9 |
0.016 |
10 |
2 |
0 |
0.316 |
2 |
|
D |
148 |
35 |
13977 |
◊ |
A |
x,y,z |
1_555 |
142 |
38 |
13539 |
1313.5 |
-15.9 |
0.029 |
9 |
0 |
0 |
0.316 |
| Average: |
1406.5 |
-17.4 |
0.023 |
10 |
1 |
0 |
0.316 |
| 2 |
3 |
|
D |
137 |
30 |
13977 |
◊ |
C |
x,y,z |
1_555 |
142 |
30 |
14156 |
1282.2 |
-0.8 |
0.541 |
24 |
24 |
0 |
0.261 |
4 |
|
B |
142 |
30 |
13985 |
◊ |
A |
x,y,z |
1_555 |
138 |
30 |
13539 |
1276.8 |
-0.1 |
0.548 |
22 |
24 |
0 |
0.261 |
| Average: |
1279.5 |
-0.5 |
0.545 |
23 |
24 |
0 |
0.261 |
| 3 |
5 |
|
B |
48 |
14 |
13985 |
◊ |
A |
-y+3/2,x-1/2,z+3/4 |
3_645 |
46 |
15 |
13539 |
379.8 |
-1.9 |
0.382 |
6 |
1 |
0 |
0.000 |
| 4 |
6 |
|
[ADP]A:1001 |
26 |
1 |
571 |
f |
A |
x,y,z |
1_555 |
49 |
19 |
13539 |
357.0 |
-1.8 |
0.574 |
6 |
0 |
0 |
0.142 |
7 |
|
[ADP]C:1001 |
26 |
1 |
573 |
f |
C |
x,y,z |
1_555 |
45 |
17 |
14156 |
355.1 |
-1.6 |
0.681 |
5 |
0 |
0 |
0.142 |
8 |
|
[ADP]D:1001 |
26 |
1 |
570 |
f |
D |
x,y,z |
1_555 |
49 |
19 |
13977 |
352.1 |
-2.2 |
0.599 |
5 |
0 |
0 |
0.142 |
9 |
|
[ADP]B:1001 |
24 |
1 |
572 |
f |
B |
x,y,z |
1_555 |
44 |
18 |
13985 |
311.1 |
-0.8 |
0.520 |
4 |
0 |
0 |
0.142 |
| Average: |
343.8 |
-1.6 |
0.594 |
5 |
0 |
0 |
0.142 |
| 5 |
10 |
|
A |
30 |
11 |
13539 |
x |
A |
-y+3/2,x-1/2,z-1/4 |
3_644 |
41 |
12 |
13539 |
327.5 |
1.2 |
0.566 |
5 |
0 |
0 |
0.000 |
| 6 |
11 |
|
D |
29 |
10 |
13977 |
◊ |
C |
-y+2,-x+2,-z+1/2 |
8_775 |
32 |
13 |
14156 |
265.0 |
1.4 |
0.671 |
2 |
1 |
0 |
0.000 |
| 7 |
12 |
|
D |
17 |
5 |
13977 |
◊ |
A |
-y+3/2,x-1/2,z-1/4 |
3_644 |
19 |
5 |
13539 |
185.5 |
2.7 |
0.828 |
2 |
4 |
0 |
0.000 |
| 8 |
13 |
|
B |
21 |
8 |
13985 |
x |
B |
-y+3/2,x-1/2,z-1/4 |
3_644 |
14 |
6 |
13985 |
163.6 |
1.3 |
0.726 |
3 |
0 |
0 |
0.000 |
| 9 |
14 |
|
D |
12 |
5 |
13977 |
◊ |
B |
x,y,z |
1_555 |
12 |
5 |
13985 |
130.3 |
-0.8 |
0.423 |
2 |
0 |
0 |
0.022 |
15 |
|
C |
11 |
4 |
14156 |
◊ |
A |
x,y,z |
1_555 |
11 |
4 |
13539 |
108.6 |
-0.9 |
0.386 |
2 |
0 |
0 |
0.022 |
| Average: |
119.5 |
-0.8 |
0.405 |
2 |
0 |
0 |
0.022 |
| 10 |
16 |
|
[GOL]A:1004 |
6 |
1 |
222 |
f |
A |
x,y,z |
1_555 |
16 |
10 |
13539 |
122.8 |
1.6 |
0.598 |
4 |
0 |
0 |
0.002 |
| 11 |
17 |
|
[PO4]D:1002 |
5 |
1 |
193 |
f |
D |
x,y,z |
1_555 |
19 |
10 |
13977 |
117.5 |
-7.4 |
0.717 |
6 |
0 |
0 |
0.173 |
| 12 |
18 |
|
[PO4]B:1002 |
5 |
1 |
194 |
f |
B |
x,y,z |
1_555 |
20 |
9 |
13985 |
116.2 |
-7.1 |
0.726 |
7 |
0 |
0 |
0.138 |
| 13 |
19 |
|
[PO4]C:1002 |
5 |
1 |
194 |
f |
C |
x,y,z |
1_555 |
20 |
9 |
14156 |
115.0 |
-7.1 |
0.729 |
8 |
0 |
0 |
0.184 |
| 14 |
20 |
|
[PO4]A:1002 |
5 |
1 |
193 |
f |
A |
x,y,z |
1_555 |
20 |
9 |
13539 |
114.8 |
-7.2 |
0.724 |
7 |
0 |
0 |
0.137 |
| 15 |
21 |
|
D |
9 |
3 |
13977 |
◊ |
C |
y,x,-z+1 |
7_556 |
14 |
4 |
14156 |
107.5 |
0.6 |
0.659 |
1 |
0 |
0 |
0.000 |
| 16 |
22 |
|
D |
16 |
6 |
13977 |
◊ |
D |
y,x,-z |
7_555 |
16 |
6 |
13977 |
99.9 |
1.6 |
0.763 |
0 |
0 |
0 |
0.000 |
| 17 |
23 |
|
[CL]B:1004 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
11 |
4 |
13985 |
67.1 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.121 |
| 18 |
24 |
|
[MG]D:1003 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
12 |
6 |
13977 |
52.0 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.154 |
25 |
|
[MG]B:1003 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
13985 |
45.4 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.154 |
26 |
|
[MG]A:1003 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
13539 |
45.0 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.154 |
| Average: |
47.5 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.154 |
| 19 |
27 |
|
[MG]D:1004 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
8 |
3 |
13977 |
39.1 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.141 |
28 |
|
[MG]D:1004 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
13985 |
39.1 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.141 |
| Average: |
39.1 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.141 |
| 20 |
29 |
|
[MG]B:1003 |
1 |
1 |
98 |
f |
[ADP]B:1001 |
x,y,z |
1_555 |
5 |
1 |
572 |
37.0 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.153 |
30 |
|
[MG]A:1003 |
1 |
1 |
98 |
f |
[ADP]A:1001 |
x,y,z |
1_555 |
4 |
1 |
571 |
35.9 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.153 |
31 |
|
[MG]D:1003 |
1 |
1 |
98 |
f |
[ADP]D:1001 |
x,y,z |
1_555 |
5 |
1 |
570 |
34.6 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.153 |
| Average: |
35.8 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.153 |
| 21 |
32 |
|
B |
3 |
1 |
13985 |
◊ |
A |
-y+3/2,x-1/2,z-1/4 |
3_644 |
4 |
2 |
13539 |
36.5 |
1.0 |
0.843 |
0 |
0 |
0 |
0.000 |
| 22 |
33 |
|
[PO4]B:1002 |
4 |
1 |
194 |
f |
[ADP]B:1001 |
x,y,z |
1_555 |
4 |
1 |
572 |
19.4 |
-1.5 |
0.733 |
0 |
0 |
0 |
0.020 |
| 23 |
34 |
|
[PO4]A:1002 |
4 |
1 |
193 |
f |
[ADP]A:1001 |
x,y,z |
1_555 |
4 |
1 |
571 |
18.8 |
-1.5 |
0.730 |
0 |
0 |
0 |
0.020 |
| 24 |
35 |
|
[PO4]C:1002 |
4 |
1 |
194 |
f |
[ADP]C:1001 |
x,y,z |
1_555 |
4 |
1 |
573 |
18.7 |
-1.5 |
0.740 |
0 |
0 |
0 |
0.026 |
| 25 |
36 |
|
[PO4]D:1002 |
3 |
1 |
193 |
f |
[ADP]D:1001 |
x,y,z |
1_555 |
4 |
1 |
570 |
17.9 |
-1.5 |
0.739 |
0 |
0 |
0 |
0.025 |
| 26 |
37 |
|
C |
3 |
1 |
14156 |
◊ |
C |
y,x,-z+1 |
7_556 |
3 |
1 |
14156 |
14.4 |
0.3 |
0.710 |
0 |
0 |
0 |
0.000 |
| 27 |
38 |
|
B |
2 |
1 |
13985 |
◊ |
C |
-y+3/2,x-1/2,z-1/4 |
3_644 |
2 |
1 |
14156 |
13.6 |
-0.4 |
0.287 |
0 |
0 |
0 |
0.000 |
| 28 |
39 |
|
[GOL]A:1004 |
2 |
1 |
222 |
f |
[PO4]A:1002 |
x,y,z |
1_555 |
1 |
1 |
193 |
7.9 |
-0.4 |
0.683 |
0 |
0 |
0 |
0.005 |
| 29 |
40 |
|
D |
3 |
1 |
13977 |
x |
D |
-y+3/2,x-1/2,z-1/4 |
3_644 |
1 |
1 |
13977 |
3.7 |
0.0 |
0.655 |
0 |
0 |
0 |
0.000 |
| 30 |
41 |
|
D |
2 |
1 |
13977 |
◊ |
C |
x,y,z-1 |
1_554 |
2 |
1 |
14156 |
2.3 |
-0.1 |
0.553 |
0 |
0 |
0 |
0.000 |
| 31 |
42 |
|
[MG]A:1003 |
1 |
1 |
98 |
f |
[PO4]A:1002 |
x,y,z |
1_555 |
1 |
1 |
193 |
1.4 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.003 |
| 32 |
43 |
|
D |
1 |
1 |
13977 |
◊ |
C |
-x+2,-y+2,z-1/2 |
2_774 |
1 |
1 |
14156 |
1.2 |
0.1 |
0.714 |
0 |
0 |
0 |
0.000 |
|