## |
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 |
|
D |
56 |
18 |
11574 |
◊ |
D |
-x+1,y,-z+2 |
2_657 |
56 |
18 |
11574 |
503.8 |
1.5 |
0.826 |
8 |
6 |
0 |
0.000 |
2 |
|
B |
48 |
16 |
11450 |
◊ |
A |
-x+3/2,y-1/2,-z+1 |
4_646 |
48 |
15 |
11667 |
411.5 |
3.0 |
0.889 |
9 |
3 |
0 |
0.000 |
Average: |
457.7 |
2.3 |
0.858 |
9 |
5 |
0 |
0.000 |
2 |
3 |
|
D |
37 |
11 |
11574 |
◊ |
A |
x,y,z |
1_555 |
48 |
13 |
11667 |
415.0 |
-1.1 |
0.590 |
4 |
3 |
0 |
0.000 |
4 |
|
B |
51 |
14 |
11450 |
◊ |
D |
x,y-1,z |
1_545 |
39 |
11 |
11574 |
404.2 |
-0.4 |
0.681 |
4 |
1 |
0 |
0.000 |
5 |
|
C |
37 |
10 |
11717 |
◊ |
A |
x,y,z |
1_555 |
38 |
13 |
11667 |
344.8 |
-1.2 |
0.546 |
4 |
4 |
0 |
0.000 |
Average: |
388.0 |
-0.9 |
0.606 |
4 |
3 |
0 |
0.000 |
3 |
6 |
|
C |
43 |
13 |
11717 |
◊ |
B |
x,y,z |
1_555 |
46 |
13 |
11450 |
397.4 |
-4.5 |
0.274 |
2 |
1 |
0 |
0.000 |
4 |
7 |
|
[NP7]B:1000 |
25 |
1 |
573 |
f |
B |
x,y,z |
1_555 |
61 |
23 |
11450 |
392.2 |
-11.2 |
0.388 |
1 |
0 |
0 |
0.441 |
8 |
|
[NP7]D:1000 |
25 |
1 |
570 |
f |
D |
x,y,z |
1_555 |
59 |
22 |
11574 |
387.8 |
-11.0 |
0.386 |
1 |
0 |
0 |
0.441 |
9 |
|
[NP7]A:1000 |
25 |
1 |
571 |
f |
A |
x,y,z |
1_555 |
63 |
22 |
11667 |
387.8 |
-10.9 |
0.369 |
1 |
0 |
0 |
0.441 |
10 |
|
[NP7]C:1000 |
25 |
1 |
572 |
f |
C |
x,y,z |
1_555 |
59 |
21 |
11717 |
387.2 |
-11.1 |
0.371 |
1 |
0 |
0 |
0.441 |
Average: |
388.7 |
-11.1 |
0.379 |
1 |
0 |
0 |
0.441 |
5 |
11 |
|
D |
31 |
13 |
11574 |
◊ |
C |
x,y,z |
1_555 |
33 |
9 |
11717 |
307.0 |
-2.3 |
0.360 |
2 |
0 |
0 |
0.000 |
12 |
|
B |
23 |
8 |
11450 |
◊ |
A |
x,y,z |
1_555 |
25 |
12 |
11667 |
217.4 |
-2.9 |
0.251 |
0 |
0 |
0 |
0.000 |
Average: |
262.2 |
-2.6 |
0.306 |
1 |
0 |
0 |
0.000 |
6 |
13 |
|
C |
42 |
14 |
11717 |
◊ |
C |
-x+1,y,-z+2 |
2_657 |
42 |
14 |
11717 |
302.8 |
2.4 |
0.858 |
6 |
4 |
0 |
0.000 |
7 |
14 |
|
B |
24 |
12 |
11450 |
◊ |
A |
x,y-1,z |
1_545 |
21 |
7 |
11667 |
223.5 |
-2.1 |
0.336 |
0 |
0 |
0 |
0.000 |
8 |
15 |
|
A |
22 |
11 |
11667 |
◊ |
D |
x,y,z-1 |
1_554 |
20 |
10 |
11574 |
184.8 |
1.6 |
0.814 |
3 |
2 |
0 |
0.000 |
16 |
|
B |
22 |
11 |
11450 |
◊ |
C |
x,y,z-1 |
1_554 |
16 |
9 |
11717 |
139.5 |
3.0 |
0.924 |
3 |
2 |
0 |
0.000 |
17 |
|
B |
14 |
8 |
11450 |
◊ |
D |
x,y-1,z-1 |
1_544 |
18 |
9 |
11574 |
122.9 |
1.2 |
0.808 |
2 |
3 |
0 |
0.000 |
18 |
|
A |
10 |
7 |
11667 |
◊ |
C |
x,y,z-1 |
1_554 |
18 |
10 |
11717 |
112.6 |
2.3 |
0.888 |
3 |
3 |
0 |
0.000 |
Average: |
140.0 |
2.0 |
0.859 |
3 |
3 |
0 |
0.000 |
9 |
19 |
|
C |
20 |
10 |
11717 |
◊ |
D |
x,y-1,z |
1_545 |
19 |
6 |
11574 |
174.8 |
-2.8 |
0.222 |
0 |
0 |
0 |
0.000 |
10 |
20 |
|
[EDO]A:2014 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
26 |
10 |
11667 |
123.7 |
3.1 |
0.422 |
1 |
0 |
0 |
0.000 |
11 |
21 |
|
[EDO]A:2020 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
11667 |
111.2 |
3.3 |
0.442 |
2 |
0 |
0 |
0.000 |
22 |
|
[EDO]C:2021 |
4 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
11 |
6 |
11717 |
108.5 |
3.4 |
0.438 |
2 |
0 |
0 |
0.000 |
Average: |
109.8 |
3.4 |
0.440 |
2 |
0 |
0 |
0.000 |
12 |
23 |
|
[EDO]D:2012 |
4 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
10 |
6 |
11574 |
108.6 |
3.3 |
0.447 |
2 |
0 |
0 |
0.000 |
13 |
24 |
|
[EDO]C:2017 |
4 |
1 |
184 |
◊ |
C |
x,y,z |
1_555 |
20 |
8 |
11717 |
107.6 |
3.2 |
0.609 |
3 |
0 |
0 |
0.000 |
14 |
25 |
|
[EDO]B:2000 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
11450 |
107.5 |
3.2 |
0.449 |
3 |
0 |
0 |
0.000 |
15 |
26 |
|
[EDO]D:2016 |
4 |
1 |
183 |
◊ |
D |
x,y,z |
1_555 |
17 |
7 |
11574 |
107.1 |
3.4 |
0.601 |
2 |
0 |
0 |
0.000 |
16 |
27 |
|
[EDO]B:2007 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
11450 |
105.0 |
2.7 |
0.428 |
1 |
0 |
0 |
0.000 |
17 |
28 |
|
[EDO]B:2006 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
11450 |
105.0 |
3.2 |
0.457 |
3 |
0 |
0 |
0.000 |
18 |
29 |
|
[EDO]C:2008 |
4 |
1 |
183 |
f |
C |
x,y,z |
1_555 |
14 |
6 |
11717 |
105.0 |
2.8 |
0.429 |
1 |
0 |
0 |
0.000 |
19 |
30 |
|
[EDO]D:2011 |
4 |
1 |
183 |
f |
D |
x,y,z |
1_555 |
12 |
6 |
11574 |
100.6 |
3.5 |
0.468 |
3 |
0 |
0 |
0.000 |
20 |
31 |
|
[EDO]A:2004 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
11667 |
99.5 |
3.5 |
0.455 |
3 |
0 |
0 |
0.000 |
21 |
32 |
|
[EDO]A:2002 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
21 |
9 |
11667 |
98.4 |
3.1 |
0.491 |
2 |
0 |
0 |
0.000 |
22 |
33 |
|
[EDO]C:2009 |
4 |
1 |
184 |
◊ |
C |
x,y,z |
1_555 |
14 |
6 |
11717 |
95.6 |
2.9 |
0.511 |
2 |
0 |
0 |
0.000 |
23 |
34 |
|
[EDO]B:2005 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
19 |
8 |
11450 |
93.5 |
3.5 |
0.493 |
0 |
0 |
0 |
0.000 |
24 |
35 |
|
[EDO]A:2015 |
4 |
1 |
182 |
◊ |
A |
x,y,z |
1_555 |
13 |
7 |
11667 |
92.3 |
2.9 |
0.313 |
3 |
0 |
0 |
0.000 |
25 |
36 |
|
[EDO]C:2010 |
4 |
1 |
183 |
◊ |
C |
x,y,z |
1_555 |
13 |
7 |
11717 |
90.9 |
3.0 |
0.425 |
1 |
0 |
0 |
0.000 |
26 |
37 |
|
[EDO]D:2019 |
4 |
1 |
184 |
◊ |
D |
x,y,z |
1_555 |
14 |
6 |
11574 |
89.7 |
2.9 |
0.471 |
2 |
0 |
0 |
0.000 |
27 |
38 |
|
B |
12 |
5 |
11450 |
◊ |
[EDO]A:2013 |
x,y-1,z |
1_545 |
4 |
1 |
184 |
79.9 |
2.0 |
0.224 |
0 |
0 |
0 |
0.000 |
28 |
39 |
|
B |
13 |
7 |
11450 |
◊ |
[EDO]A:2018 |
x,y-1,z |
1_545 |
4 |
1 |
184 |
79.4 |
2.6 |
0.451 |
2 |
0 |
0 |
0.000 |
29 |
40 |
|
[EDO]B:2001 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
11450 |
77.9 |
1.9 |
0.280 |
3 |
0 |
0 |
0.000 |
30 |
41 |
|
[EDO]B:2022 |
4 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
14 |
4 |
11450 |
70.5 |
1.4 |
0.640 |
0 |
0 |
0 |
0.000 |
31 |
42 |
|
[EDO]A:2003 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
11667 |
68.8 |
2.5 |
0.938 |
1 |
0 |
0 |
0.000 |
32 |
43 |
|
[EDO]A:2018 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
11667 |
65.6 |
1.0 |
0.630 |
2 |
0 |
0 |
0.000 |
33 |
44 |
|
[EDO]A:2013 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
11667 |
60.5 |
1.8 |
0.891 |
2 |
0 |
0 |
0.000 |
34 |
45 |
|
[EDO]B:2022 |
4 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
7 |
2 |
11717 |
56.3 |
1.4 |
0.709 |
1 |
0 |
0 |
0.000 |
35 |
46 |
|
[EDO]D:2019 |
4 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
7 |
2 |
11717 |
51.7 |
1.2 |
0.715 |
1 |
0 |
0 |
0.000 |
36 |
47 |
|
[EDO]B:2022 |
4 |
1 |
186 |
f |
[EDO]B:2005 |
x,y,z |
1_555 |
4 |
1 |
184 |
37.5 |
1.9 |
1.000 |
0 |
0 |
0 |
0.000 |
37 |
48 |
|
[EDO]C:2010 |
3 |
1 |
183 |
f |
D |
x,y-1,z |
1_545 |
5 |
2 |
11574 |
35.2 |
0.5 |
0.762 |
1 |
0 |
0 |
0.000 |
38 |
49 |
|
[EDO]A:2003 |
3 |
1 |
185 |
f |
[EDO]A:2002 |
x,y,z |
1_555 |
4 |
1 |
186 |
34.9 |
1.4 |
1.000 |
1 |
0 |
0 |
0.000 |
39 |
50 |
|
B |
2 |
1 |
11450 |
f |
[EDO]C:2009 |
x,y,z-1 |
1_554 |
2 |
1 |
184 |
29.9 |
0.7 |
0.479 |
0 |
0 |
0 |
0.000 |
40 |
51 |
|
[EDO]B:2001 |
3 |
1 |
184 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
11717 |
26.4 |
1.4 |
0.993 |
1 |
0 |
0 |
0.000 |
41 |
52 |
|
[EDO]C:2017 |
2 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
6 |
4 |
11450 |
25.3 |
0.2 |
0.645 |
0 |
0 |
0 |
0.000 |
42 |
53 |
|
[EDO]D:2016 |
1 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
2 |
1 |
11667 |
18.4 |
-0.0 |
0.520 |
0 |
0 |
0 |
0.000 |
43 |
54 |
|
[EDO]A:2015 |
2 |
1 |
182 |
f |
C |
x,y,z-1 |
1_554 |
2 |
1 |
11717 |
17.6 |
0.4 |
0.547 |
0 |
0 |
0 |
0.000 |
44 |
55 |
|
[EDO]A:2013 |
1 |
1 |
184 |
f |
[EDO]A:2004 |
x,y,z |
1_555 |
1 |
1 |
184 |
5.2 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
45 |
56 |
|
A |
2 |
1 |
11667 |
◊ |
D |
-x+3/2,y-1/2,-z+2 |
4_647 |
1 |
1 |
11574 |
5.0 |
-0.1 |
0.412 |
0 |
0 |
0 |
0.000 |
46 |
57 |
|
C |
1 |
1 |
11717 |
◊ |
B |
-x+1,y,-z+1 |
2_656 |
1 |
1 |
11450 |
0.3 |
-0.0 |
0.594 |
0 |
0 |
0 |
0.000 |
|