## |
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 |
215 |
49 |
14189 |
◊ |
A |
x,y,z |
1_555 |
229 |
55 |
14240 |
2106.8 |
-11.7 |
0.227 |
37 |
17 |
0 |
0.350 |
2 |
|
D |
220 |
52 |
13901 |
◊ |
B |
x,y,z |
1_555 |
233 |
53 |
14159 |
2094.0 |
-9.4 |
0.296 |
35 |
17 |
0 |
0.350 |
Average: |
2100.4 |
-10.6 |
0.261 |
36 |
17 |
0 |
0.350 |
2 |
3 |
|
B |
74 |
16 |
14159 |
◊ |
A |
x,y-1,z |
1_545 |
71 |
19 |
14240 |
629.8 |
1.0 |
0.597 |
14 |
2 |
0 |
0.000 |
4 |
|
B |
72 |
19 |
14159 |
◊ |
A |
x,y,z |
1_555 |
70 |
16 |
14240 |
627.7 |
0.9 |
0.500 |
12 |
6 |
0 |
0.000 |
Average: |
628.8 |
1.0 |
0.548 |
13 |
4 |
0 |
0.000 |
3 |
5 |
|
B |
53 |
15 |
14159 |
◊ |
C |
x,y-1,z |
1_545 |
51 |
11 |
14189 |
503.1 |
2.7 |
0.787 |
8 |
4 |
0 |
0.000 |
6 |
|
D |
46 |
11 |
13901 |
◊ |
A |
x,y,z |
1_555 |
49 |
16 |
14240 |
425.1 |
1.0 |
0.658 |
3 |
3 |
0 |
0.000 |
Average: |
464.1 |
1.9 |
0.723 |
6 |
4 |
0 |
0.000 |
4 |
7 |
|
C |
38 |
11 |
14189 |
◊ |
A |
-y+1,x-y+1,z-1/3 |
2_664 |
42 |
14 |
14240 |
365.8 |
-2.0 |
0.241 |
4 |
1 |
0 |
0.007 |
5 |
8 |
|
[GPP]A:1298 |
19 |
1 |
516 |
f |
A |
x,y,z |
1_555 |
59 |
23 |
14240 |
358.2 |
3.0 |
0.657 |
12 |
0 |
0 |
0.071 |
9 |
|
[GPP]B:1298 |
19 |
1 |
515 |
f |
B |
x,y,z |
1_555 |
56 |
22 |
14159 |
358.1 |
3.0 |
0.660 |
13 |
0 |
0 |
0.071 |
10 |
|
[GPP]C:1298 |
19 |
1 |
513 |
f |
C |
x,y,z |
1_555 |
53 |
22 |
14189 |
350.2 |
2.7 |
0.652 |
11 |
0 |
0 |
0.071 |
11 |
|
[GPP]D:1298 |
19 |
1 |
514 |
f |
D |
x,y,z |
1_555 |
57 |
23 |
13901 |
340.8 |
2.9 |
0.664 |
13 |
0 |
0 |
0.071 |
Average: |
351.8 |
2.9 |
0.658 |
12 |
0 |
0 |
0.071 |
6 |
12 |
|
C |
34 |
10 |
14189 |
◊ |
D |
-y,x-y,z-1/3 |
2_554 |
38 |
11 |
13901 |
302.7 |
-0.3 |
0.551 |
4 |
0 |
0 |
0.000 |
7 |
13 |
|
A |
24 |
8 |
14240 |
◊ |
D |
-y,x-y,z-1/3 |
2_554 |
23 |
5 |
13901 |
209.9 |
-0.3 |
0.535 |
1 |
0 |
0 |
0.000 |
8 |
14 |
|
[SO4]C:1299 |
5 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
15 |
5 |
14189 |
80.0 |
-11.1 |
0.766 |
3 |
0 |
0 |
0.142 |
9 |
15 |
|
[PO4]B:1299 |
5 |
1 |
187 |
◊ |
B |
x,y,z |
1_555 |
12 |
6 |
14159 |
76.4 |
-3.5 |
0.887 |
3 |
0 |
0 |
0.060 |
10 |
16 |
|
[PO4]A:1299 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
14240 |
76.4 |
-3.4 |
0.880 |
5 |
0 |
0 |
0.064 |
11 |
17 |
|
B |
7 |
3 |
14159 |
◊ |
D |
-y,x-y,z-1/3 |
2_554 |
7 |
1 |
13901 |
75.9 |
-0.4 |
0.466 |
0 |
0 |
0 |
0.000 |
12 |
18 |
|
[PO4]B:1300 |
5 |
1 |
189 |
f |
B |
x,y,z |
1_555 |
10 |
2 |
14159 |
71.8 |
-4.0 |
0.776 |
2 |
0 |
0 |
0.061 |
13 |
19 |
|
[PO4]A:1299 |
5 |
1 |
188 |
◊ |
C |
x,y,z |
1_555 |
11 |
5 |
14189 |
71.8 |
-4.1 |
0.732 |
2 |
0 |
0 |
0.057 |
14 |
20 |
|
[PO4]B:1299 |
5 |
1 |
187 |
f |
D |
x,y,z |
1_555 |
12 |
5 |
13901 |
70.1 |
-4.3 |
0.639 |
2 |
0 |
0 |
0.065 |
15 |
21 |
|
[PO4]B:1300 |
5 |
1 |
189 |
◊ |
A |
x,y,z |
1_555 |
9 |
6 |
14240 |
63.3 |
-3.2 |
0.841 |
2 |
0 |
0 |
0.000 |
16 |
22 |
|
[GOL]C:1300 |
4 |
1 |
218 |
f |
C |
x,y,z |
1_555 |
11 |
3 |
14189 |
57.3 |
-0.0 |
0.548 |
0 |
0 |
0 |
0.000 |
17 |
23 |
|
[CL]B:1302 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
13 |
3 |
14159 |
50.4 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.081 |
24 |
|
[CL]B:1301 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
14 |
3 |
14240 |
49.6 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.081 |
Average: |
50.0 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.081 |
18 |
25 |
|
[SO4]C:1299 |
4 |
1 |
184 |
◊ |
A |
-y+1,x-y+1,z-1/3 |
2_664 |
9 |
4 |
14240 |
49.6 |
-7.0 |
0.645 |
1 |
0 |
0 |
0.013 |
19 |
26 |
|
[CL]B:1302 |
1 |
1 |
125 |
◊ |
A |
x,y-1,z |
1_545 |
8 |
3 |
14240 |
48.9 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.000 |
27 |
|
[CL]B:1301 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
14159 |
48.6 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
48.7 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.000 |
20 |
28 |
|
[MG]C:1297 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
6 |
5 |
14189 |
39.9 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.089 |
29 |
|
[MG]D:1297 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
6 |
4 |
13901 |
39.4 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.089 |
30 |
|
[MG]B:1297 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
6 |
14159 |
39.0 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.089 |
31 |
|
[MG]A:1297 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
6 |
14240 |
37.4 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.089 |
Average: |
38.9 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.089 |
21 |
32 |
|
[GPP]D:1298 |
4 |
1 |
514 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
14159 |
36.1 |
-0.6 |
0.496 |
1 |
0 |
0 |
0.026 |
33 |
|
[GPP]C:1298 |
4 |
1 |
513 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
14240 |
33.6 |
-0.8 |
0.497 |
1 |
0 |
0 |
0.026 |
34 |
|
[GPP]A:1298 |
3 |
1 |
516 |
◊ |
C |
x,y,z |
1_555 |
6 |
2 |
14189 |
30.0 |
-1.1 |
0.418 |
0 |
0 |
0 |
0.026 |
Average: |
33.2 |
-0.8 |
0.471 |
1 |
0 |
0 |
0.026 |
22 |
35 |
|
[GPP]C:1298 |
3 |
1 |
513 |
f |
[MG]C:1297 |
x,y,z |
1_555 |
1 |
1 |
98 |
33.4 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.131 |
36 |
|
[GPP]D:1298 |
4 |
1 |
514 |
f |
[MG]D:1297 |
x,y,z |
1_555 |
1 |
1 |
98 |
33.1 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.131 |
37 |
|
[GPP]B:1298 |
4 |
1 |
515 |
f |
[MG]B:1297 |
x,y,z |
1_555 |
1 |
1 |
98 |
32.6 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.131 |
38 |
|
[GPP]A:1298 |
4 |
1 |
516 |
f |
[MG]A:1297 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.2 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.131 |
Average: |
32.6 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.131 |
23 |
39 |
|
[GPP]B:1298 |
3 |
1 |
515 |
◊ |
D |
x,y,z |
1_555 |
6 |
2 |
13901 |
23.3 |
-1.3 |
0.421 |
0 |
0 |
0 |
0.016 |
24 |
40 |
|
B |
2 |
1 |
14159 |
◊ |
[GPP]C:1298 |
x,y-1,z |
1_545 |
3 |
1 |
513 |
19.8 |
-0.5 |
0.548 |
0 |
0 |
0 |
0.000 |
41 |
|
[GPP]D:1298 |
2 |
1 |
514 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
14240 |
18.1 |
-0.7 |
0.551 |
0 |
0 |
0 |
0.000 |
Average: |
19.0 |
-0.6 |
0.549 |
0 |
0 |
0 |
0.000 |
25 |
42 |
|
[PO4]B:1300 |
1 |
1 |
189 |
◊ |
[GPP]D:1298 |
x,y,z |
1_555 |
3 |
1 |
514 |
15.9 |
-1.6 |
0.552 |
0 |
0 |
0 |
0.020 |
26 |
43 |
|
B |
3 |
1 |
14159 |
◊ |
A |
-y+1,x-y,z-1/3 |
2_654 |
1 |
1 |
14240 |
14.7 |
0.4 |
0.802 |
0 |
0 |
0 |
0.000 |
27 |
44 |
|
[MG]A:1297 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
14189 |
14.4 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.022 |
45 |
|
[MG]C:1297 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
14240 |
14.3 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.022 |
46 |
|
[MG]D:1297 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
14159 |
14.1 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.022 |
47 |
|
[MG]B:1297 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
13901 |
7.9 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.022 |
Average: |
12.7 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.022 |
28 |
48 |
|
[PO4]B:1300 |
4 |
1 |
189 |
◊ |
D |
x,y,z |
1_555 |
2 |
2 |
13901 |
12.6 |
-0.2 |
0.933 |
0 |
0 |
0 |
0.003 |
29 |
49 |
|
[PO4]B:1299 |
3 |
1 |
187 |
◊ |
[MG]B:1297 |
x,y,z |
1_555 |
1 |
1 |
98 |
11.8 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.022 |
30 |
50 |
|
[PO4]A:1299 |
3 |
1 |
188 |
f |
[MG]A:1297 |
x,y,z |
1_555 |
1 |
1 |
98 |
11.2 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.018 |
31 |
51 |
|
C |
3 |
1 |
14189 |
◊ |
D |
-y+1,x-y+1,z-1/3 |
2_664 |
2 |
1 |
13901 |
8.7 |
-0.0 |
0.551 |
0 |
0 |
0 |
0.000 |
32 |
52 |
|
D |
1 |
1 |
13901 |
◊ |
C |
x-1,y-1,z |
1_445 |
1 |
1 |
14189 |
7.7 |
0.2 |
0.817 |
0 |
0 |
0 |
0.000 |
33 |
53 |
|
D |
1 |
1 |
13901 |
◊ |
[GOL]C:1300 |
x-1,y-1,z |
1_445 |
1 |
1 |
218 |
0.2 |
0.0 |
0.571 |
0 |
0 |
0 |
0.000 |
34 |
54 |
|
[PO4]B:1299 |
1 |
1 |
187 |
◊ |
[GPP]B:1298 |
x,y,z |
1_555 |
1 |
1 |
515 |
0.2 |
-0.0 |
0.503 |
0 |
0 |
0 |
0.000 |
|