| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
A |
92 |
35 |
9806 |
◊ |
A |
-x,y,-z |
2_555 |
93 |
35 |
9806 |
857.8 |
-4.9 |
0.252 |
6 |
0 |
0 |
0.075 |
2 |
|
A |
63 |
14 |
9806 |
◊ |
B |
x-1/2,y+1/2,z-1 |
3_454 |
65 |
16 |
9473 |
515.6 |
1.8 |
0.698 |
11 |
0 |
0 |
0.000 |
3 |
|
A |
36 |
14 |
9806 |
◊ |
A |
-x,y,-z+1 |
2_556 |
36 |
14 |
9806 |
392.3 |
-0.3 |
0.523 |
4 |
10 |
0 |
0.000 |
4 |
|
B |
40 |
10 |
9473 |
x |
B |
-x+1/2,y-1/2,-z+1 |
4_546 |
43 |
15 |
9473 |
339.2 |
0.9 |
0.643 |
5 |
1 |
0 |
0.000 |
5 |
|
[55H]B:305 |
21 |
1 |
470 |
◊ |
B |
x,y,z |
1_555 |
43 |
14 |
9473 |
309.2 |
1.6 |
0.434 |
3 |
0 |
0 |
0.000 |
6 |
|
B |
30 |
9 |
9473 |
◊ |
A |
-x,y,-z+1 |
2_556 |
26 |
9 |
9806 |
255.5 |
-1.9 |
0.268 |
3 |
0 |
0 |
0.000 |
7 |
|
B |
25 |
8 |
9473 |
◊ |
A |
x,y,z |
1_555 |
22 |
6 |
9806 |
246.4 |
-3.5 |
0.136 |
2 |
0 |
0 |
0.000 |
8 |
|
B |
24 |
8 |
9473 |
◊ |
A |
-x,y,-z |
2_555 |
31 |
12 |
9806 |
217.4 |
2.1 |
0.740 |
5 |
0 |
0 |
0.000 |
9 |
|
B |
21 |
9 |
9473 |
◊ |
A |
-x,y-1,-z+1 |
2_546 |
26 |
9 |
9806 |
181.5 |
2.3 |
0.808 |
3 |
3 |
0 |
0.000 |
10 |
|
[MPD]A:301 |
7 |
1 |
276 |
f |
A |
x,y,z |
1_555 |
22 |
9 |
9806 |
142.8 |
-9.9 |
0.484 |
2 |
0 |
0 |
0.212 |
11 |
|
[MPD]B:301 |
7 |
1 |
277 |
f |
B |
x,y,z |
1_555 |
22 |
9 |
9473 |
134.5 |
-9.4 |
0.517 |
1 |
0 |
0 |
0.021 |
12 |
|
[MPD]B:302 |
7 |
1 |
279 |
f |
B |
x,y,z |
1_555 |
20 |
8 |
9473 |
131.9 |
-8.4 |
0.668 |
1 |
0 |
0 |
0.018 |
13 |
|
[MPD]B:303 |
7 |
1 |
281 |
f |
B |
x,y,z |
1_555 |
24 |
6 |
9473 |
129.2 |
-8.2 |
0.631 |
1 |
0 |
0 |
0.018 |
14 |
|
[MPD]A:302 |
6 |
1 |
279 |
f |
A |
x,y,z |
1_555 |
18 |
7 |
9806 |
127.1 |
-8.3 |
0.579 |
1 |
0 |
0 |
0.173 |
15 |
|
B |
10 |
4 |
9473 |
◊ |
A |
x,y-1,z |
1_545 |
9 |
2 |
9806 |
97.4 |
-0.8 |
0.371 |
2 |
0 |
0 |
0.000 |
16 |
|
B |
10 |
5 |
9473 |
◊ |
A |
-x,y-1,-z |
2_545 |
9 |
3 |
9806 |
96.6 |
-0.2 |
0.507 |
1 |
2 |
0 |
0.000 |
17 |
|
[MPD]B:302 |
4 |
1 |
279 |
◊ |
B |
-x+1/2,y-1/2,-z+1 |
4_546 |
10 |
3 |
9473 |
70.4 |
-4.1 |
0.616 |
0 |
0 |
0 |
0.000 |
18 |
|
[CL]A:303 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
9806 |
69.6 |
-10.5 |
0.000 |
0 |
0 |
0 |
0.207 |
19 |
|
[CL]B:304 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
11 |
8 |
9473 |
54.8 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.015 |
20 |
|
[MPD]B:303 |
5 |
1 |
281 |
f |
[MPD]B:301 |
x,y,z |
1_555 |
5 |
1 |
277 |
53.7 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.011 |
21 |
|
[55H]B:305 |
3 |
1 |
470 |
f |
A |
-x,y-1,-z+1 |
2_546 |
6 |
2 |
9806 |
48.8 |
-0.4 |
0.331 |
0 |
0 |
0 |
0.007 |
22 |
|
[MG]B:306 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
4 |
9473 |
46.1 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.010 |
23 |
|
[MG]A:304 |
1 |
1 |
98 |
f |
[MG]A:304 |
-x,y,-z |
2_555 |
1 |
1 |
98 |
42.8 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.100 |
24 |
|
B |
7 |
4 |
9473 |
◊ |
[CL]B:304 |
-x+1/2,y-1/2,-z+1 |
4_546 |
1 |
1 |
125 |
41.6 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.000 |
25 |
|
[MG]A:304 |
1 |
1 |
98 |
x |
A |
x,y,z |
1_555 |
5 |
3 |
9806 |
40.1 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.172 |
26 |
|
[MPD]A:302 |
3 |
1 |
279 |
◊ |
B |
-x,y,-z+1 |
2_556 |
3 |
2 |
9473 |
38.4 |
-2.4 |
0.309 |
0 |
0 |
0 |
0.000 |
27 |
|
[MPD]B:302 |
4 |
1 |
279 |
f |
[MPD]B:301 |
x,y,z |
1_555 |
2 |
1 |
277 |
35.9 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.007 |
28 |
|
[MPD]A:302 |
3 |
1 |
279 |
f |
[MPD]A:301 |
x,y,z |
1_555 |
4 |
1 |
276 |
32.0 |
-3.1 |
0.000 |
1 |
0 |
0 |
0.069 |
29 |
|
[MPD]B:301 |
1 |
1 |
277 |
◊ |
B |
-x+1/2,y-1/2,-z+1 |
4_546 |
1 |
1 |
9473 |
7.5 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.000 |
|