## |
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 |
79 |
27 |
8286 |
◊ |
D |
-x+1,y-1/2,-z |
2_645 |
79 |
28 |
8326 |
700.1 |
-0.8 |
0.820 |
14 |
3 |
0 |
0.006 |
2 |
|
B |
74 |
25 |
8350 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
77 |
27 |
8435 |
668.0 |
-2.7 |
0.688 |
5 |
1 |
0 |
0.006 |
Average: |
684.0 |
-1.7 |
0.754 |
10 |
2 |
0 |
0.006 |
2 |
3 |
|
A |
62 |
21 |
8286 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
71 |
22 |
8435 |
568.7 |
-4.4 |
0.454 |
7 |
0 |
0 |
0.000 |
4 |
|
B |
59 |
20 |
8350 |
◊ |
D |
-x+2,y-1/2,-z+1 |
2_746 |
65 |
20 |
8326 |
536.3 |
-7.4 |
0.276 |
5 |
0 |
0 |
0.000 |
Average: |
552.5 |
-5.9 |
0.365 |
6 |
0 |
0 |
0.000 |
3 |
5 |
|
B |
53 |
16 |
8350 |
◊ |
D |
x,y-1,z |
1_545 |
49 |
18 |
8326 |
477.0 |
-6.2 |
0.230 |
2 |
0 |
0 |
0.000 |
6 |
|
A |
45 |
15 |
8286 |
◊ |
C |
x,y-1,z-1 |
1_544 |
43 |
14 |
8435 |
428.5 |
-3.9 |
0.278 |
4 |
0 |
0 |
0.000 |
Average: |
452.8 |
-5.0 |
0.254 |
3 |
0 |
0 |
0.000 |
4 |
7 |
|
D |
26 |
9 |
8326 |
◊ |
B |
x,y,z |
1_555 |
34 |
9 |
8350 |
277.9 |
-2.7 |
0.460 |
3 |
0 |
0 |
0.000 |
8 |
|
A |
32 |
9 |
8286 |
◊ |
C |
x,y,z-1 |
1_554 |
25 |
8 |
8435 |
271.6 |
-2.3 |
0.451 |
3 |
0 |
0 |
0.000 |
Average: |
274.8 |
-2.5 |
0.455 |
3 |
0 |
0 |
0.000 |
5 |
9 |
|
C |
32 |
10 |
8435 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
30 |
9 |
8326 |
265.1 |
-1.4 |
0.548 |
2 |
2 |
0 |
0.000 |
10 |
|
D |
32 |
10 |
8326 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
29 |
8 |
8435 |
257.9 |
-1.5 |
0.529 |
1 |
2 |
0 |
0.000 |
Average: |
261.5 |
-1.4 |
0.539 |
2 |
2 |
0 |
0.000 |
6 |
11 |
|
B |
32 |
11 |
8350 |
◊ |
C |
-x+1,y-1/2,-z+2 |
2_647 |
23 |
8 |
8435 |
238.3 |
-0.6 |
0.642 |
4 |
0 |
0 |
0.000 |
12 |
|
A |
26 |
10 |
8286 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
19 |
8 |
8326 |
211.4 |
-0.1 |
0.722 |
2 |
0 |
0 |
0.000 |
Average: |
224.8 |
-0.3 |
0.682 |
3 |
0 |
0 |
0.000 |
7 |
13 |
|
B |
17 |
5 |
8350 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
26 |
6 |
8326 |
188.6 |
-1.7 |
0.462 |
4 |
0 |
0 |
0.000 |
8 |
14 |
|
B |
21 |
7 |
8350 |
x |
B |
-x+2,y-1/2,-z+1 |
2_746 |
24 |
7 |
8350 |
185.2 |
-2.0 |
0.446 |
0 |
5 |
0 |
0.000 |
15 |
|
A |
19 |
8 |
8286 |
x |
A |
-x+1,y-1/2,-z |
2_645 |
22 |
6 |
8286 |
180.4 |
-1.0 |
0.529 |
1 |
3 |
0 |
0.000 |
Average: |
182.8 |
-1.5 |
0.487 |
1 |
4 |
0 |
0.000 |
9 |
16 |
|
A |
20 |
4 |
8286 |
◊ |
C |
-x,y-1/2,-z+1 |
2_546 |
21 |
7 |
8435 |
180.1 |
-0.1 |
0.686 |
2 |
0 |
0 |
0.000 |
10 |
17 |
|
[ZN]C:501 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
7 |
4 |
8435 |
49.4 |
-32.8 |
0.000 |
0 |
0 |
0 |
0.060 |
18 |
|
[ZN]B:501 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
8350 |
49.2 |
-33.5 |
0.000 |
0 |
0 |
0 |
0.060 |
19 |
|
[ZN]D:501 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
7 |
4 |
8326 |
49.2 |
-33.1 |
0.000 |
0 |
0 |
0 |
0.060 |
20 |
|
[ZN]A:501 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
8286 |
49.1 |
-33.4 |
0.000 |
0 |
0 |
0 |
0.060 |
Average: |
49.2 |
-33.2 |
0.000 |
0 |
0 |
0 |
0.060 |
11 |
21 |
|
A |
4 |
2 |
8286 |
◊ |
D |
x,y-1,z |
1_545 |
8 |
4 |
8326 |
48.6 |
0.7 |
0.693 |
0 |
0 |
0 |
0.000 |
12 |
22 |
|
[CA]C:504 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
10 |
7 |
8435 |
46.1 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.022 |
23 |
|
[CA]B:504 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
9 |
7 |
8350 |
46.0 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.022 |
24 |
|
[CA]D:504 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
9 |
7 |
8326 |
45.7 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.022 |
25 |
|
[CA]A:504 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
9 |
7 |
8286 |
45.7 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.022 |
Average: |
45.9 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.022 |
13 |
26 |
|
[CA]D:505 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
8 |
6 |
8326 |
45.5 |
-10.6 |
0.000 |
0 |
0 |
0 |
0.019 |
27 |
|
[CA]B:505 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
6 |
5 |
8350 |
45.5 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.019 |
28 |
|
[CA]C:505 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
9 |
6 |
8435 |
44.3 |
-10.2 |
0.000 |
0 |
0 |
0 |
0.019 |
29 |
|
[CA]A:505 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
8286 |
44.0 |
-10.0 |
0.000 |
0 |
0 |
0 |
0.019 |
Average: |
44.8 |
-10.4 |
0.000 |
0 |
0 |
0 |
0.019 |
14 |
30 |
|
B |
5 |
2 |
8350 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
8286 |
44.1 |
-1.2 |
0.177 |
0 |
0 |
0 |
0.000 |
15 |
31 |
|
A |
5 |
2 |
8286 |
◊ |
B |
x-1,y,z-1 |
1_454 |
3 |
1 |
8350 |
30.1 |
-0.7 |
0.359 |
0 |
0 |
0 |
0.000 |
16 |
32 |
|
D |
4 |
3 |
8326 |
◊ |
C |
x,y,z-1 |
1_554 |
4 |
2 |
8435 |
23.2 |
-0.4 |
0.467 |
0 |
0 |
0 |
0.000 |
17 |
33 |
|
[CA]A:505 |
1 |
1 |
85 |
◊ |
D |
-x+1,y-1/2,-z |
2_645 |
3 |
3 |
8326 |
17.1 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.002 |
34 |
|
B |
3 |
3 |
8350 |
◊ |
[CA]C:505 |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
85 |
15.3 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.002 |
35 |
|
[CA]B:505 |
1 |
1 |
85 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
2 |
2 |
8435 |
5.6 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.002 |
36 |
|
A |
1 |
1 |
8286 |
◊ |
[CA]D:505 |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
85 |
4.0 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.002 |
Average: |
10.5 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.002 |
18 |
37 |
|
C |
1 |
1 |
8435 |
◊ |
B |
x-1,y+1,z |
1_465 |
1 |
1 |
8350 |
4.1 |
0.1 |
0.562 |
0 |
0 |
0 |
0.000 |
19 |
38 |
|
C |
1 |
1 |
8435 |
x |
C |
-x,y-1/2,-z+2 |
2_547 |
1 |
1 |
8435 |
1.7 |
0.1 |
0.624 |
0 |
0 |
0 |
0.000 |
20 |
39 |
|
[CA]B:503 |
1 |
1 |
85 |
f |
D |
-x+2,y-1/2,-z+1 |
2_746 |
1 |
1 |
8326 |
0.5 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
|