| ## |
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 |
99 |
33 |
16998 |
x |
A |
x-1/2,-y+3/2,-z+1 |
4_466 |
107 |
37 |
16998 |
986.5 |
0.5 |
0.566 |
14 |
0 |
0 |
0.000 |
| 2 |
2 |
|
B |
50 |
14 |
17188 |
◊ |
A |
x,y,z |
1_555 |
60 |
18 |
16998 |
479.5 |
-0.2 |
0.506 |
7 |
6 |
0 |
0.000 |
| 3 |
3 |
|
A |
42 |
12 |
16998 |
◊ |
B |
x-1/2,-y+3/2,-z+1 |
4_466 |
44 |
12 |
17188 |
405.4 |
3.0 |
0.772 |
7 |
12 |
0 |
0.000 |
| 4 |
4 |
|
[AN2]B:503 |
27 |
1 |
573 |
f |
B |
x,y,z |
1_555 |
64 |
24 |
17188 |
384.7 |
-4.7 |
0.400 |
12 |
0 |
0 |
0.049 |
5 |
|
[AN2]A:503 |
27 |
1 |
584 |
f |
A |
x,y,z |
1_555 |
64 |
24 |
16998 |
383.2 |
-3.1 |
0.423 |
9 |
0 |
0 |
0.049 |
| Average: |
384.0 |
-3.9 |
0.411 |
11 |
0 |
0 |
0.049 |
| 5 |
6 |
|
B |
34 |
14 |
17188 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
36 |
10 |
16998 |
315.8 |
2.0 |
0.725 |
7 |
1 |
0 |
0.000 |
| 6 |
7 |
|
B |
39 |
15 |
17188 |
x |
B |
x-1/2,-y+3/2,-z |
4_465 |
36 |
12 |
17188 |
295.8 |
0.8 |
0.613 |
2 |
2 |
0 |
0.000 |
| 7 |
8 |
|
[SYQ]B:502 |
15 |
1 |
412 |
f |
B |
x,y,z |
1_555 |
28 |
14 |
17188 |
230.3 |
4.7 |
0.268 |
1 |
0 |
0 |
0.000 |
| 8 |
9 |
|
[GOL]B:504 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
24 |
11 |
17188 |
148.3 |
-0.2 |
0.526 |
3 |
0 |
0 |
0.007 |
| 9 |
10 |
|
[PG6]A:502 |
8 |
1 |
296 |
◊ |
A |
x,y,z |
1_555 |
20 |
7 |
16998 |
146.4 |
5.3 |
0.267 |
1 |
0 |
0 |
0.000 |
| 10 |
11 |
|
[GOL]B:506 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
24 |
12 |
17188 |
139.3 |
0.5 |
0.590 |
3 |
0 |
0 |
0.004 |
| 11 |
12 |
|
[GOL]A:504 |
6 |
1 |
212 |
f |
A |
x,y,z |
1_555 |
21 |
11 |
16998 |
138.4 |
-1.3 |
0.426 |
4 |
0 |
0 |
0.007 |
| 12 |
13 |
|
[GOL]A:507 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
24 |
9 |
16998 |
137.6 |
1.0 |
0.637 |
5 |
0 |
0 |
0.003 |
| 13 |
14 |
|
[GOL]B:507 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
25 |
9 |
17188 |
137.5 |
1.0 |
0.667 |
1 |
0 |
0 |
0.000 |
| 14 |
15 |
|
[GOL]A:501 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
20 |
6 |
16998 |
133.1 |
0.6 |
0.646 |
2 |
0 |
0 |
0.000 |
| 15 |
16 |
|
[GOL]A:508 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
20 |
11 |
16998 |
132.6 |
0.1 |
0.591 |
5 |
0 |
0 |
0.004 |
| 16 |
17 |
|
[GOL]B:505 |
6 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
16 |
5 |
17188 |
126.1 |
0.2 |
0.582 |
4 |
0 |
0 |
0.008 |
| 17 |
18 |
|
[PO4]B:508 |
5 |
1 |
193 |
f |
B |
x,y,z |
1_555 |
22 |
13 |
17188 |
116.7 |
-6.9 |
0.692 |
5 |
0 |
0 |
0.045 |
| 18 |
19 |
|
[PO4]A:509 |
5 |
1 |
193 |
f |
A |
x,y,z |
1_555 |
21 |
11 |
16998 |
111.8 |
-7.1 |
0.693 |
5 |
0 |
0 |
0.020 |
| 19 |
20 |
|
[GOL]A:505 |
5 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
16998 |
100.9 |
0.4 |
0.603 |
4 |
0 |
0 |
0.003 |
| 20 |
21 |
|
[GOL]A:506 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
17 |
5 |
16998 |
96.8 |
-0.3 |
0.494 |
0 |
0 |
0 |
0.000 |
| 21 |
22 |
|
[GOL]B:501 |
6 |
1 |
218 |
◊ |
B |
x,y,z |
1_555 |
12 |
3 |
17188 |
90.5 |
0.5 |
0.661 |
2 |
0 |
0 |
0.000 |
| 22 |
23 |
|
[CL]A:511 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
15 |
9 |
16998 |
75.7 |
-11.1 |
0.000 |
0 |
0 |
0 |
0.024 |
| 23 |
24 |
|
[GOL]B:501 |
5 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
16998 |
70.4 |
-0.3 |
0.509 |
1 |
0 |
0 |
0.002 |
| 24 |
25 |
|
[CL]A:510 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
16998 |
57.2 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.015 |
| 25 |
26 |
|
[AN2]A:503 |
5 |
1 |
584 |
f |
[GOL]A:508 |
x,y,z |
1_555 |
5 |
1 |
218 |
42.8 |
0.3 |
0.607 |
2 |
0 |
0 |
0.001 |
| 26 |
27 |
|
[AN2]B:503 |
5 |
1 |
573 |
f |
[GOL]B:506 |
x,y,z |
1_555 |
6 |
1 |
219 |
38.2 |
0.5 |
0.621 |
0 |
0 |
0 |
0.000 |
| 27 |
28 |
|
[PO4]B:508 |
4 |
1 |
193 |
f |
[AN2]B:503 |
x,y,z |
1_555 |
4 |
1 |
573 |
37.5 |
-2.2 |
0.694 |
1 |
0 |
0 |
0.013 |
| 28 |
29 |
|
[PO4]A:509 |
4 |
1 |
193 |
f |
[AN2]A:503 |
x,y,z |
1_555 |
4 |
1 |
584 |
33.4 |
-2.6 |
0.584 |
0 |
0 |
0 |
0.006 |
| 29 |
30 |
|
B |
4 |
2 |
17188 |
◊ |
A |
-x+3/2,-y+1,z-1/2 |
2_664 |
3 |
1 |
16998 |
29.6 |
0.3 |
0.697 |
0 |
0 |
0 |
0.000 |
| 30 |
31 |
|
[AN2]B:503 |
5 |
1 |
573 |
f |
[GOL]B:507 |
x,y,z |
1_555 |
2 |
1 |
219 |
28.9 |
0.3 |
0.688 |
0 |
0 |
0 |
0.000 |
| 31 |
32 |
|
B |
5 |
3 |
17188 |
x |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
5 |
3 |
17188 |
26.5 |
-0.1 |
0.451 |
0 |
0 |
0 |
0.000 |
| 32 |
33 |
|
[AN2]A:503 |
5 |
1 |
584 |
f |
[GOL]A:507 |
x,y,z |
1_555 |
2 |
1 |
220 |
26.5 |
0.5 |
0.611 |
0 |
0 |
0 |
0.000 |
| 33 |
34 |
|
[GOL]A:507 |
2 |
1 |
220 |
f |
[GOL]A:506 |
x,y,z |
1_555 |
2 |
1 |
217 |
20.7 |
0.4 |
0.722 |
1 |
0 |
0 |
0.000 |
| 34 |
35 |
|
[PG6]A:502 |
1 |
1 |
296 |
f |
A |
x-1/2,-y+3/2,-z+1 |
4_466 |
2 |
1 |
16998 |
10.7 |
0.1 |
0.343 |
0 |
0 |
0 |
0.000 |
| 35 |
36 |
|
[PO4]A:509 |
2 |
1 |
193 |
f |
[GOL]A:504 |
x,y,z |
1_555 |
2 |
1 |
212 |
9.1 |
-0.6 |
0.748 |
0 |
0 |
0 |
0.001 |
| 36 |
37 |
|
[PO4]B:508 |
3 |
1 |
193 |
f |
[GOL]B:504 |
x,y,z |
1_555 |
1 |
1 |
218 |
6.4 |
-0.2 |
0.704 |
0 |
0 |
0 |
0.001 |
| 37 |
38 |
|
[GOL]B:507 |
1 |
1 |
219 |
f |
[GOL]B:506 |
x,y,z |
1_555 |
1 |
1 |
219 |
2.7 |
0.1 |
0.500 |
0 |
0 |
0 |
0.000 |
|