## |
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 |
89 |
28 |
11400 |
◊ |
B |
x,y,z |
1_555 |
91 |
26 |
11325 |
806.6 |
-11.7 |
0.115 |
3 |
1 |
0 |
0.105 |
2 |
|
D |
88 |
28 |
11329 |
◊ |
A |
-y-1/3,x-y+1/3,z+1/3 |
5_455 |
88 |
27 |
11252 |
796.1 |
-11.1 |
0.156 |
3 |
2 |
0 |
0.105 |
Average: |
801.3 |
-11.4 |
0.135 |
3 |
2 |
0 |
0.105 |
2 |
3 |
|
C |
46 |
16 |
11400 |
◊ |
A |
x,y,z |
1_555 |
60 |
20 |
11252 |
487.7 |
-3.5 |
0.413 |
9 |
0 |
0 |
0.055 |
4 |
|
D |
48 |
17 |
11329 |
◊ |
B |
-y-1/3,x-y+1/3,z+1/3 |
5_455 |
58 |
20 |
11325 |
486.2 |
-4.1 |
0.392 |
7 |
0 |
0 |
0.055 |
Average: |
486.9 |
-3.8 |
0.402 |
8 |
0 |
0 |
0.055 |
3 |
5 |
|
B |
52 |
16 |
11325 |
◊ |
A |
x,y,z |
1_555 |
51 |
15 |
11252 |
465.4 |
-2.6 |
0.568 |
3 |
0 |
0 |
0.015 |
4 |
6 |
|
D |
38 |
13 |
11329 |
◊ |
B |
x,y,z |
1_555 |
45 |
15 |
11325 |
393.8 |
0.2 |
0.773 |
8 |
4 |
0 |
0.032 |
7 |
|
C |
39 |
14 |
11400 |
◊ |
A |
-y-1/3,x-y+1/3,z+1/3 |
5_455 |
46 |
14 |
11252 |
393.3 |
0.2 |
0.759 |
9 |
4 |
0 |
0.032 |
Average: |
393.6 |
0.2 |
0.766 |
9 |
4 |
0 |
0.032 |
5 |
8 |
|
[J8N]A:302 |
23 |
1 |
564 |
f |
A |
x,y,z |
1_555 |
46 |
22 |
11252 |
368.4 |
-9.0 |
0.337 |
8 |
0 |
0 |
0.106 |
9 |
|
[J8N]B:302 |
23 |
1 |
561 |
f |
B |
x,y,z |
1_555 |
43 |
22 |
11325 |
366.4 |
-10.2 |
0.300 |
7 |
0 |
0 |
0.106 |
Average: |
367.4 |
-9.6 |
0.319 |
8 |
0 |
0 |
0.106 |
6 |
10 |
|
C |
39 |
12 |
11400 |
x |
C |
-y,x-y,z |
2_555 |
39 |
13 |
11400 |
361.5 |
-2.9 |
0.422 |
1 |
3 |
0 |
0.000 |
7 |
11 |
|
[J8N]D:302 |
23 |
1 |
540 |
f |
D |
x,y,z |
1_555 |
47 |
22 |
11329 |
348.1 |
-9.2 |
0.295 |
8 |
0 |
0 |
0.099 |
12 |
|
[J8N]C:302 |
23 |
1 |
541 |
f |
C |
x,y,z |
1_555 |
44 |
21 |
11400 |
339.6 |
-8.9 |
0.282 |
8 |
0 |
0 |
0.099 |
Average: |
343.9 |
-9.0 |
0.288 |
8 |
0 |
0 |
0.099 |
8 |
13 |
|
B |
21 |
7 |
11325 |
x |
B |
-y,x-y,z |
2_555 |
30 |
9 |
11325 |
269.0 |
-1.7 |
0.506 |
3 |
0 |
0 |
0.000 |
9 |
14 |
|
[J8N]D:303 |
23 |
1 |
587 |
f |
D |
x,y,z |
1_555 |
33 |
13 |
11329 |
241.2 |
-2.6 |
0.533 |
3 |
0 |
0 |
0.034 |
15 |
|
[J8N]C:303 |
22 |
1 |
582 |
f |
C |
x,y,z |
1_555 |
34 |
13 |
11400 |
239.3 |
-2.5 |
0.518 |
4 |
0 |
0 |
0.034 |
Average: |
240.2 |
-2.5 |
0.526 |
4 |
0 |
0 |
0.034 |
10 |
16 |
|
D |
19 |
9 |
11329 |
◊ |
C |
x,y,z |
1_555 |
18 |
10 |
11400 |
196.3 |
-2.1 |
0.358 |
0 |
0 |
0 |
0.008 |
11 |
17 |
|
D |
18 |
7 |
11329 |
◊ |
B |
-x+y-1/3,-x+1/3,z+1/3 |
6_455 |
21 |
8 |
11325 |
181.0 |
1.5 |
0.848 |
1 |
0 |
0 |
0.000 |
12 |
18 |
|
C |
22 |
8 |
11400 |
◊ |
B |
-y,x-y,z |
2_555 |
15 |
4 |
11325 |
174.1 |
0.5 |
0.617 |
3 |
0 |
0 |
0.000 |
13 |
19 |
|
[J8N]C:303 |
15 |
1 |
582 |
◊ |
D |
x,y,z |
1_555 |
13 |
4 |
11329 |
114.6 |
-1.8 |
0.688 |
0 |
0 |
0 |
0.012 |
20 |
|
[J8N]D:303 |
15 |
1 |
587 |
◊ |
C |
x,y,z |
1_555 |
15 |
4 |
11400 |
111.6 |
-1.6 |
0.698 |
0 |
0 |
0 |
0.012 |
Average: |
113.1 |
-1.7 |
0.693 |
0 |
0 |
0 |
0.012 |
14 |
21 |
|
[J8N]D:303 |
11 |
1 |
587 |
◊ |
[J8N]C:303 |
x,y,z |
1_555 |
12 |
1 |
582 |
102.7 |
-0.9 |
0.747 |
0 |
0 |
0 |
0.003 |
15 |
22 |
|
C |
4 |
2 |
11400 |
◊ |
D |
-y,x-y,z |
2_555 |
9 |
4 |
11329 |
66.3 |
0.5 |
0.581 |
0 |
0 |
0 |
0.000 |
16 |
23 |
|
A |
4 |
2 |
11252 |
◊ |
B |
-y,x-y,z |
2_555 |
7 |
2 |
11325 |
65.9 |
-1.1 |
0.168 |
0 |
0 |
0 |
0.000 |
17 |
24 |
|
[J8N]D:303 |
4 |
1 |
587 |
f |
[J8N]D:302 |
x,y,z |
1_555 |
5 |
1 |
540 |
48.4 |
-3.8 |
0.304 |
0 |
0 |
0 |
0.028 |
25 |
|
[J8N]C:303 |
4 |
1 |
582 |
f |
[J8N]C:302 |
x,y,z |
1_555 |
6 |
1 |
541 |
45.5 |
-3.6 |
0.336 |
0 |
0 |
0 |
0.028 |
Average: |
47.0 |
-3.7 |
0.320 |
0 |
0 |
0 |
0.028 |
18 |
26 |
|
[ZN]C:301 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
6 |
5 |
11400 |
35.8 |
-26.4 |
0.000 |
0 |
0 |
0 |
0.413 |
27 |
|
[ZN]B:301 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
6 |
11325 |
35.4 |
-25.2 |
0.000 |
0 |
0 |
0 |
0.413 |
28 |
|
[ZN]D:301 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
6 |
5 |
11329 |
35.3 |
-26.4 |
0.000 |
0 |
0 |
0 |
0.413 |
29 |
|
[ZN]A:301 |
1 |
1 |
98 |
cf |
A |
x,y,z |
1_555 |
7 |
6 |
11252 |
34.7 |
-25.3 |
0.000 |
0 |
0 |
0 |
0.413 |
Average: |
35.3 |
-25.8 |
0.000 |
0 |
0 |
0 |
0.413 |
19 |
30 |
|
[J8N]A:302 |
5 |
1 |
564 |
f |
[ZN]A:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
32.9 |
-13.6 |
0.000 |
0 |
0 |
0 |
0.215 |
31 |
|
[J8N]C:302 |
4 |
1 |
541 |
f |
[ZN]C:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
32.8 |
-13.3 |
0.000 |
0 |
0 |
0 |
0.215 |
32 |
|
[J8N]D:302 |
4 |
1 |
540 |
cf |
[ZN]D:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
32.6 |
-13.7 |
0.000 |
0 |
0 |
0 |
0.215 |
33 |
|
[J8N]B:302 |
5 |
1 |
561 |
f |
[ZN]B:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
32.1 |
-13.6 |
0.000 |
0 |
0 |
0 |
0.215 |
Average: |
32.6 |
-13.5 |
0.000 |
0 |
0 |
0 |
0.215 |
|