## |
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 |
|
D |
28 |
6 |
1821 |
◊ |
C |
x,y,z |
1_555 |
30 |
5 |
1737 |
286.0 |
-1.2 |
0.494 |
16 |
0 |
0 |
0.576 |
2 |
|
B |
29 |
6 |
1821 |
◊ |
A |
x,y,z |
1_555 |
28 |
5 |
1737 |
282.3 |
-2.3 |
0.474 |
16 |
0 |
0 |
0.472 |
3 |
|
[XTR]C:4 |
19 |
1 |
453 |
cf |
C |
x,y,z |
1_555 |
34 |
2 |
1737 |
242.3 |
3.6 |
0.723 |
0 |
0 |
0 |
0.000 |
4 |
|
[XTR]A:4 |
19 |
1 |
476 |
cf |
A |
x,y,z |
1_555 |
31 |
2 |
1737 |
241.6 |
3.0 |
0.755 |
1 |
0 |
0 |
0.000 |
5 |
|
B |
25 |
2 |
1821 |
◊ |
D |
-x+1,y-1/2,-z+1/2 |
3_645 |
26 |
4 |
1821 |
214.0 |
2.8 |
0.674 |
1 |
0 |
0 |
0.000 |
6 |
|
A |
25 |
3 |
1737 |
◊ |
C |
-x+1,y-1/2,-z+1/2 |
3_645 |
25 |
3 |
1737 |
185.1 |
6.1 |
0.842 |
2 |
0 |
0 |
0.000 |
7 |
|
C |
25 |
3 |
1737 |
◊ |
A |
x-1/2,-y+5/2,-z+1 |
4_476 |
25 |
3 |
1737 |
175.8 |
6.5 |
0.857 |
2 |
0 |
0 |
0.000 |
8 |
|
C |
18 |
2 |
1737 |
◊ |
B |
x-1/2,-y+5/2,-z+1 |
4_476 |
15 |
2 |
1821 |
123.6 |
-0.8 |
0.500 |
1 |
0 |
0 |
0.000 |
9 |
|
B |
18 |
4 |
1821 |
◊ |
D |
x,y-1,z |
1_545 |
17 |
3 |
1821 |
123.0 |
-3.3 |
0.323 |
0 |
0 |
0 |
0.179 |
10 |
|
A |
18 |
2 |
1737 |
◊ |
D |
-x+1,y-1/2,-z+1/2 |
3_645 |
14 |
2 |
1821 |
122.4 |
0.6 |
0.569 |
1 |
0 |
0 |
0.000 |
11 |
|
D |
15 |
2 |
1821 |
◊ |
B |
x-1/2,-y+5/2,-z+1 |
4_476 |
12 |
3 |
1821 |
96.6 |
1.4 |
0.624 |
0 |
0 |
0 |
0.000 |
12 |
|
D |
9 |
1 |
1821 |
x |
D |
x-1/2,-y+7/2,-z+1 |
4_486 |
13 |
3 |
1821 |
93.7 |
3.1 |
0.753 |
0 |
0 |
0 |
0.000 |
13 |
|
[NCO]D:62 |
4 |
1 |
266 |
f |
D |
x,y,z |
1_555 |
11 |
3 |
1821 |
86.4 |
-0.4 |
0.282 |
7 |
0 |
0 |
0.241 |
14 |
|
[NCO]C:64 |
4 |
1 |
266 |
f |
C |
x,y,z |
1_555 |
8 |
2 |
1737 |
70.9 |
-1.2 |
0.124 |
5 |
0 |
0 |
0.239 |
15 |
|
[NCO]B:61 |
4 |
1 |
264 |
◊ |
D |
x,y-1,z |
1_545 |
8 |
3 |
1821 |
68.0 |
-0.1 |
0.165 |
4 |
0 |
0 |
0.101 |
16 |
|
[NCO]B:61 |
4 |
1 |
264 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
1821 |
64.6 |
-1.7 |
0.213 |
4 |
0 |
0 |
0.192 |
17 |
|
[XTR]A:4 |
6 |
1 |
476 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
1821 |
62.2 |
0.5 |
0.592 |
2 |
0 |
0 |
0.020 |
18 |
|
[XTR]C:4 |
6 |
1 |
453 |
◊ |
D |
x,y,z |
1_555 |
8 |
4 |
1821 |
60.1 |
0.1 |
0.509 |
1 |
0 |
0 |
0.024 |
19 |
|
[NCO]D:62 |
4 |
1 |
266 |
◊ |
A |
x-1/2,-y+5/2,-z+1 |
4_476 |
6 |
2 |
1737 |
59.0 |
-0.9 |
0.570 |
4 |
0 |
0 |
0.000 |
20 |
|
[XTR]C:4 |
7 |
1 |
453 |
◊ |
[NCO]C:64 |
x-1/2,-y+5/2,-z+1 |
4_476 |
3 |
1 |
266 |
57.9 |
-0.7 |
0.312 |
4 |
0 |
0 |
0.000 |
21 |
|
A |
7 |
2 |
1737 |
f |
[NCO]A:63 |
-x+2,y-1/2,-z+1/2 |
3_745 |
4 |
1 |
263 |
57.8 |
-1.2 |
0.123 |
4 |
0 |
0 |
0.149 |
22 |
|
[NCO]C:66 |
4 |
1 |
265 |
f |
A |
x-1/2,-y+5/2,-z+1 |
4_476 |
10 |
2 |
1737 |
57.5 |
-1.0 |
0.253 |
4 |
0 |
0 |
0.139 |
23 |
|
C |
8 |
1 |
1737 |
◊ |
[NCO]B:65 |
x-1,y+1,z |
1_465 |
4 |
1 |
265 |
55.8 |
-0.2 |
0.276 |
2 |
0 |
0 |
0.000 |
24 |
|
[NCO]B:61 |
3 |
1 |
264 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
6 |
2 |
1821 |
54.8 |
-1.3 |
0.522 |
3 |
0 |
0 |
0.000 |
25 |
|
[NCO]D:62 |
3 |
1 |
266 |
◊ |
D |
x-1/2,-y+7/2,-z+1 |
4_486 |
7 |
2 |
1821 |
54.2 |
-0.3 |
0.361 |
3 |
0 |
0 |
0.000 |
26 |
|
[NCO]B:61 |
4 |
1 |
264 |
◊ |
C |
x,y-1,z |
1_545 |
3 |
2 |
1737 |
53.3 |
-0.5 |
0.223 |
3 |
0 |
0 |
0.058 |
27 |
|
D |
8 |
1 |
1821 |
◊ |
[NCO]B:65 |
x-1/2,-y+5/2,-z+1 |
4_476 |
3 |
1 |
265 |
52.5 |
-0.2 |
0.233 |
2 |
0 |
0 |
0.000 |
28 |
|
[NCO]B:65 |
3 |
1 |
265 |
f |
B |
x,y,z |
1_555 |
6 |
2 |
1821 |
52.2 |
-2.1 |
0.135 |
3 |
0 |
0 |
0.189 |
29 |
|
[NCO]B:65 |
3 |
1 |
265 |
◊ |
D |
x,y-1,z |
1_545 |
8 |
2 |
1821 |
47.9 |
-1.4 |
0.513 |
3 |
0 |
0 |
0.150 |
30 |
|
B |
6 |
2 |
1821 |
◊ |
[NCO]A:63 |
-x+1,y-1/2,-z+1/2 |
3_645 |
3 |
1 |
263 |
47.4 |
0.2 |
0.244 |
3 |
0 |
0 |
0.000 |
31 |
|
[NCO]D:62 |
4 |
1 |
266 |
◊ |
B |
x-1/2,-y+5/2,-z+1 |
4_476 |
6 |
3 |
1821 |
44.7 |
-0.6 |
0.632 |
1 |
0 |
0 |
0.000 |
32 |
|
C |
5 |
1 |
1737 |
◊ |
[XTR]A:4 |
x-1/2,-y+5/2,-z+1 |
4_476 |
4 |
1 |
476 |
43.3 |
0.5 |
0.570 |
0 |
0 |
0 |
0.000 |
33 |
|
C |
6 |
2 |
1737 |
◊ |
[NCO]C:64 |
x-1/2,-y+5/2,-z+1 |
4_476 |
3 |
1 |
266 |
43.2 |
-0.7 |
0.187 |
1 |
0 |
0 |
0.000 |
34 |
|
[NCO]C:67 |
3 |
1 |
185 |
◊ |
A |
x-1,y+1,z |
1_465 |
7 |
2 |
1737 |
42.4 |
-0.4 |
0.614 |
2 |
0 |
0 |
0.000 |
35 |
|
B |
5 |
1 |
1821 |
x |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
4 |
1 |
1821 |
41.0 |
-0.3 |
0.459 |
1 |
0 |
0 |
0.000 |
36 |
|
[NCO]C:64 |
4 |
1 |
266 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
1737 |
37.0 |
0.1 |
0.178 |
1 |
0 |
0 |
0.000 |
37 |
|
[NCO]C:66 |
2 |
1 |
265 |
◊ |
C |
x-1/2,-y+5/2,-z+1 |
4_476 |
7 |
2 |
1737 |
35.0 |
1.2 |
0.404 |
0 |
0 |
0 |
0.000 |
38 |
|
A |
3 |
1 |
1737 |
◊ |
[XTR]C:4 |
-x+1,y-1/2,-z+1/2 |
3_645 |
2 |
1 |
453 |
34.9 |
0.7 |
0.563 |
0 |
0 |
0 |
0.000 |
39 |
|
D |
5 |
1 |
1821 |
◊ |
A |
x-1/2,-y+5/2,-z+1 |
4_476 |
6 |
1 |
1737 |
33.0 |
-1.2 |
0.367 |
0 |
0 |
0 |
0.000 |
40 |
|
[NCO]A:63 |
2 |
1 |
263 |
◊ |
[XTR]A:4 |
x,y,z |
1_555 |
4 |
1 |
476 |
32.8 |
-0.4 |
0.326 |
1 |
0 |
0 |
0.000 |
41 |
|
[NCO]C:67 |
2 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
3 |
1 |
1737 |
31.0 |
-2.1 |
0.441 |
1 |
0 |
0 |
0.178 |
42 |
|
D |
4 |
1 |
1821 |
◊ |
[NCO]C:67 |
-x,y-1/2,-z+1/2 |
3_545 |
2 |
1 |
185 |
30.3 |
-0.4 |
0.644 |
1 |
0 |
0 |
0.000 |
43 |
|
C |
4 |
2 |
1737 |
◊ |
[NCO]A:63 |
x-1,y,z |
1_455 |
3 |
1 |
263 |
28.7 |
0.7 |
0.259 |
0 |
0 |
0 |
0.000 |
44 |
|
[NCO]A:63 |
3 |
1 |
263 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
1821 |
28.2 |
-0.7 |
0.286 |
2 |
0 |
0 |
0.000 |
45 |
|
[NCO]C:66 |
2 |
1 |
265 |
◊ |
D |
x,y-1,z |
1_545 |
3 |
1 |
1821 |
27.9 |
0.6 |
0.808 |
0 |
0 |
0 |
0.000 |
46 |
|
C |
2 |
1 |
1737 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
1737 |
24.6 |
-1.4 |
0.253 |
0 |
0 |
0 |
0.000 |
47 |
|
[XTR]C:4 |
3 |
1 |
453 |
◊ |
[NCO]B:65 |
x-1,y+1,z |
1_465 |
2 |
1 |
265 |
13.6 |
-0.2 |
0.309 |
0 |
0 |
0 |
0.000 |
48 |
|
[NCO]C:64 |
1 |
1 |
266 |
◊ |
[XTR]A:4 |
x-1/2,-y+5/2,-z+1 |
4_476 |
1 |
1 |
476 |
13.6 |
-0.5 |
0.345 |
0 |
0 |
0 |
0.000 |
49 |
|
A |
2 |
2 |
1737 |
◊ |
D |
x,y-1,z |
1_545 |
1 |
1 |
1821 |
13.3 |
-0.5 |
0.270 |
0 |
0 |
0 |
0.016 |
50 |
|
C |
2 |
1 |
1737 |
◊ |
B |
x-1,y+1,z |
1_465 |
1 |
1 |
1821 |
12.0 |
-1.3 |
0.198 |
0 |
0 |
0 |
0.000 |
51 |
|
[NCO]D:62 |
1 |
1 |
266 |
◊ |
C |
x,y,z |
1_555 |
2 |
2 |
1737 |
11.3 |
0.1 |
0.680 |
0 |
0 |
0 |
0.000 |
52 |
|
B |
1 |
1 |
1821 |
◊ |
A |
x-1,y,z |
1_455 |
2 |
2 |
1737 |
10.2 |
-1.1 |
0.209 |
0 |
0 |
0 |
0.000 |
53 |
|
[XTR]C:4 |
1 |
1 |
453 |
◊ |
[XTR]A:4 |
x-1,y,z |
1_455 |
1 |
1 |
476 |
9.8 |
-1.0 |
0.244 |
0 |
0 |
0 |
0.000 |
54 |
|
B |
1 |
1 |
1821 |
◊ |
C |
x,y-1,z |
1_545 |
2 |
1 |
1737 |
9.4 |
-0.3 |
0.285 |
0 |
0 |
0 |
0.009 |
55 |
|
[NCO]C:64 |
1 |
1 |
266 |
◊ |
A |
x-1/2,-y+5/2,-z+1 |
4_476 |
2 |
1 |
1737 |
9.2 |
0.5 |
0.532 |
0 |
0 |
0 |
0.000 |
56 |
|
C |
1 |
1 |
1737 |
x |
C |
x-1/2,-y+5/2,-z+1 |
4_476 |
3 |
1 |
1737 |
8.5 |
-0.9 |
0.232 |
0 |
0 |
0 |
0.000 |
57 |
|
C |
2 |
1 |
1737 |
◊ |
D |
x-1,y,z |
1_455 |
1 |
1 |
1821 |
7.6 |
-0.8 |
0.208 |
0 |
0 |
0 |
0.000 |
58 |
|
[NCO]C:66 |
2 |
1 |
265 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
1737 |
7.4 |
0.1 |
0.324 |
0 |
0 |
0 |
0.000 |
59 |
|
B |
2 |
1 |
1821 |
◊ |
C |
-x+1,y-1/2,-z+1/2 |
3_645 |
2 |
1 |
1737 |
7.2 |
-0.6 |
0.289 |
0 |
0 |
0 |
0.000 |
60 |
|
D |
2 |
1 |
1821 |
◊ |
B |
x-1,y+1,z |
1_465 |
1 |
1 |
1821 |
5.9 |
-0.1 |
0.285 |
0 |
0 |
0 |
0.000 |
61 |
|
[XTR]A:4 |
1 |
1 |
476 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
1821 |
4.7 |
-0.5 |
0.235 |
0 |
0 |
0 |
0.000 |
62 |
|
[NCO]C:66 |
1 |
1 |
265 |
◊ |
B |
x-1,y,z |
1_455 |
1 |
1 |
1821 |
4.6 |
-0.1 |
0.479 |
0 |
0 |
0 |
0.000 |
63 |
|
D |
1 |
1 |
1821 |
◊ |
C |
x-1/2,-y+7/2,-z+1 |
4_486 |
1 |
1 |
1737 |
4.1 |
0.2 |
0.508 |
0 |
0 |
0 |
0.000 |
64 |
|
[NCO]B:61 |
1 |
1 |
264 |
◊ |
D |
-x+1,y-1/2,-z+1/2 |
3_645 |
2 |
1 |
1821 |
3.9 |
-0.1 |
0.397 |
0 |
0 |
0 |
0.000 |
65 |
|
[NCO]C:66 |
1 |
1 |
265 |
◊ |
[NCO]C:64 |
x,y,z |
1_555 |
1 |
1 |
266 |
2.6 |
0.0 |
1.000 |
0 |
0 |
0 |
0.000 |
66 |
|
[NCO]A:63 |
1 |
1 |
263 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
1737 |
2.2 |
-0.1 |
0.491 |
0 |
0 |
0 |
0.000 |
67 |
|
[NCO]A:63 |
1 |
1 |
263 |
◊ |
C |
-x+1,y-1/2,-z+1/2 |
3_645 |
1 |
1 |
1737 |
1.5 |
0.0 |
0.679 |
0 |
0 |
0 |
0.000 |
68 |
|
[NCO]B:61 |
1 |
1 |
264 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
1 |
1 |
1737 |
0.4 |
0.0 |
0.648 |
0 |
0 |
0 |
0.000 |
69 |
|
[NCO]C:66 |
1 |
1 |
265 |
◊ |
D |
x-1/2,-y+5/2,-z+1 |
4_476 |
1 |
1 |
1821 |
0.2 |
0.0 |
0.662 |
0 |
0 |
0 |
0.000 |
|