## |
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 |
|
B |
570 |
134 |
18100 |
◊ |
A |
x,y,z |
1_555 |
568 |
137 |
17772 |
5649.3 |
-88.0 |
0.001 |
50 |
30 |
0 |
0.593 |
2 |
2 |
|
B |
74 |
22 |
18100 |
◊ |
A |
-x,y-1/2,-z-1/2 |
3_544 |
76 |
19 |
17772 |
590.3 |
-0.9 |
0.802 |
8 |
1 |
0 |
0.000 |
3 |
3 |
|
[NDP]A:502 |
46 |
1 |
903 |
f |
A |
x,y,z |
1_555 |
87 |
31 |
17772 |
405.4 |
-2.2 |
0.648 |
13 |
0 |
0 |
0.041 |
4 |
4 |
|
[NAP]A:501 |
47 |
1 |
897 |
f |
A |
x,y,z |
1_555 |
88 |
32 |
17772 |
394.5 |
-2.2 |
0.658 |
13 |
0 |
0 |
0.041 |
5 |
5 |
|
B |
40 |
13 |
18100 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
34 |
13 |
17772 |
318.4 |
-2.3 |
0.569 |
1 |
0 |
0 |
0.000 |
6 |
6 |
|
[NDP]A:502 |
46 |
1 |
903 |
f |
[NAP]A:501 |
x,y,z |
1_555 |
45 |
1 |
897 |
296.5 |
-1.8 |
0.635 |
2 |
0 |
0 |
0.014 |
7 |
7 |
|
A |
23 |
8 |
17772 |
x |
A |
-x,y-1/2,-z-1/2 |
3_544 |
25 |
7 |
17772 |
196.0 |
-0.9 |
0.652 |
3 |
1 |
0 |
0.000 |
8 |
8 |
|
B |
20 |
5 |
18100 |
◊ |
A |
x-1,y,z |
1_455 |
24 |
8 |
17772 |
183.9 |
-0.9 |
0.590 |
0 |
0 |
0 |
0.000 |
9 |
9 |
|
[WBY]B:402 |
11 |
1 |
332 |
◊ |
A |
x,y,z |
1_555 |
21 |
10 |
17772 |
150.7 |
0.2 |
0.604 |
2 |
0 |
0 |
0.004 |
10 |
10 |
|
B |
14 |
6 |
18100 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
13 |
6 |
17772 |
125.4 |
-1.1 |
0.425 |
0 |
0 |
0 |
0.000 |
11 |
11 |
|
[WBY]B:401 |
11 |
1 |
334 |
◊ |
B |
x,y,z |
1_555 |
21 |
10 |
18100 |
109.3 |
0.4 |
0.677 |
2 |
0 |
0 |
0.003 |
12 |
12 |
|
[WBY]B:401 |
13 |
1 |
334 |
f |
A |
x,y,z |
1_555 |
27 |
10 |
17772 |
103.6 |
-2.7 |
0.399 |
0 |
0 |
0 |
0.014 |
13 |
13 |
|
B |
9 |
2 |
18100 |
x |
B |
x-1,y,z |
1_455 |
13 |
4 |
18100 |
96.8 |
-0.5 |
0.587 |
1 |
0 |
0 |
0.000 |
14 |
14 |
|
[WBY]B:402 |
9 |
1 |
332 |
f |
B |
x,y,z |
1_555 |
21 |
7 |
18100 |
82.8 |
-1.5 |
0.571 |
0 |
0 |
0 |
0.008 |
15 |
15 |
|
[NDP]A:502 |
15 |
1 |
903 |
◊ |
B |
x,y,z |
1_555 |
14 |
6 |
18100 |
55.3 |
-0.4 |
0.568 |
1 |
0 |
0 |
0.005 |
16 |
16 |
|
[NAP]A:501 |
14 |
1 |
897 |
◊ |
B |
x,y,z |
1_555 |
15 |
5 |
18100 |
55.0 |
-0.5 |
0.557 |
0 |
0 |
0 |
0.003 |
17 |
17 |
|
[MG]A:505 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
4 |
4 |
17772 |
50.7 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.049 |
18 |
18 |
|
[WBY]B:401 |
13 |
1 |
334 |
f |
[NDP]A:502 |
x,y,z |
1_555 |
11 |
1 |
903 |
48.1 |
-1.1 |
0.510 |
0 |
0 |
0 |
0.006 |
19 |
19 |
|
[WBY]B:401 |
12 |
1 |
334 |
f |
[NAP]A:501 |
x,y,z |
1_555 |
10 |
1 |
897 |
46.3 |
-1.1 |
0.490 |
0 |
0 |
0 |
0.006 |
20 |
20 |
|
[WBY]B:402 |
3 |
1 |
332 |
f |
[MG]B:403 |
x,y,z |
1_555 |
1 |
1 |
98 |
32.2 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.036 |
21 |
|
[WBY]B:401 |
3 |
1 |
334 |
f |
[MG]A:503 |
x,y,z |
1_555 |
1 |
1 |
98 |
20.4 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.036 |
Average: |
26.3 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.036 |
21 |
22 |
|
[MG]B:404 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
18100 |
31.2 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.039 |
23 |
|
[MG]A:504 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
17772 |
24.5 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.039 |
Average: |
27.9 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.039 |
22 |
24 |
|
[WBY]B:402 |
3 |
1 |
332 |
f |
[MG]B:404 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.6 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.035 |
25 |
|
[WBY]B:401 |
4 |
1 |
334 |
f |
[MG]A:504 |
x,y,z |
1_555 |
1 |
1 |
98 |
20.5 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.035 |
Average: |
25.5 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.035 |
23 |
26 |
|
[MG]B:403 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
18100 |
29.8 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.034 |
27 |
|
[MG]A:503 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
17772 |
28.8 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.034 |
Average: |
29.3 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.034 |
24 |
28 |
|
B |
4 |
2 |
18100 |
x |
B |
-x-1,y-1/2,-z-1/2 |
3_444 |
4 |
2 |
18100 |
29.2 |
0.7 |
0.834 |
1 |
1 |
0 |
0.000 |
25 |
29 |
|
B |
3 |
1 |
18100 |
x |
B |
x-1/2,-y-1/2,-z-1 |
4_444 |
7 |
4 |
18100 |
28.0 |
-0.2 |
0.525 |
0 |
0 |
0 |
0.000 |
26 |
30 |
|
B |
3 |
1 |
18100 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
2 |
1 |
17772 |
21.5 |
-0.3 |
0.380 |
0 |
0 |
0 |
0.000 |
27 |
31 |
|
[MG]B:403 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
7 |
2 |
17772 |
21.1 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.015 |
32 |
|
[MG]A:503 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
18100 |
17.7 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.015 |
Average: |
19.4 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.015 |
28 |
33 |
|
[MG]B:404 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
17772 |
15.6 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.014 |
34 |
|
[MG]A:504 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
18100 |
11.4 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.014 |
Average: |
13.5 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.014 |
29 |
35 |
|
[MG]A:504 |
1 |
1 |
98 |
f |
[NAP]A:501 |
x,y,z |
1_555 |
7 |
1 |
897 |
13.0 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.009 |
30 |
36 |
|
[MG]A:504 |
1 |
1 |
98 |
f |
[NDP]A:502 |
x,y,z |
1_555 |
8 |
1 |
903 |
12.6 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.008 |
31 |
37 |
|
A |
3 |
2 |
17772 |
x |
A |
x-1/2,-y-1/2,-z |
4_445 |
3 |
2 |
17772 |
10.6 |
0.1 |
0.675 |
0 |
0 |
0 |
0.000 |
32 |
38 |
|
[MG]A:503 |
1 |
1 |
98 |
f |
[NDP]A:502 |
x,y,z |
1_555 |
3 |
1 |
903 |
10.2 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.006 |
33 |
39 |
|
[MG]A:503 |
1 |
1 |
98 |
f |
[NAP]A:501 |
x,y,z |
1_555 |
3 |
1 |
897 |
10.1 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.006 |
34 |
40 |
|
[MG]B:404 |
1 |
1 |
98 |
f |
[MG]B:403 |
x,y,z |
1_555 |
1 |
1 |
98 |
8.0 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.009 |
35 |
41 |
|
A |
1 |
1 |
17772 |
x |
A |
-x+1/2,-y,z-1/2 |
2_554 |
1 |
1 |
17772 |
7.4 |
0.4 |
0.874 |
0 |
0 |
0 |
0.000 |
36 |
42 |
|
[MG]A:504 |
1 |
1 |
98 |
f |
[MG]A:503 |
x,y,z |
1_555 |
1 |
1 |
98 |
6.5 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.007 |
37 |
43 |
|
B |
4 |
2 |
18100 |
◊ |
[NAP]A:501 |
-x,y-1/2,-z-1/2 |
3_544 |
1 |
1 |
897 |
4.6 |
0.0 |
0.643 |
0 |
0 |
0 |
0.000 |
38 |
44 |
|
B |
2 |
1 |
18100 |
◊ |
[NDP]A:502 |
-x,y-1/2,-z-1/2 |
3_544 |
1 |
1 |
903 |
1.6 |
0.0 |
0.593 |
0 |
0 |
0 |
0.000 |
|