## |
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 |
|
E |
195 |
60 |
21699 |
◊ |
C |
x,y,z |
1_555 |
177 |
46 |
21753 |
1781.9 |
-20.3 |
0.050 |
19 |
1 |
0 |
0.751 |
2 |
|
D |
178 |
47 |
21778 |
◊ |
C |
x,y,z |
1_555 |
190 |
60 |
21753 |
1772.8 |
-21.2 |
0.035 |
17 |
1 |
0 |
0.751 |
3 |
|
F |
192 |
59 |
21732 |
◊ |
B |
x,y,z |
1_555 |
173 |
45 |
21655 |
1756.1 |
-20.6 |
0.041 |
17 |
1 |
0 |
0.751 |
4 |
|
F |
170 |
45 |
21732 |
◊ |
A |
x,y,z |
1_555 |
190 |
59 |
21751 |
1745.9 |
-21.6 |
0.031 |
17 |
1 |
0 |
0.751 |
5 |
|
E |
169 |
42 |
21699 |
◊ |
D |
x,y,z |
1_555 |
190 |
59 |
21778 |
1729.9 |
-20.3 |
0.044 |
16 |
1 |
0 |
0.751 |
6 |
|
B |
188 |
59 |
21655 |
◊ |
A |
x,y,z |
1_555 |
172 |
44 |
21751 |
1723.4 |
-19.7 |
0.051 |
18 |
1 |
0 |
0.751 |
Average: |
1751.7 |
-20.6 |
0.042 |
17 |
1 |
0 |
0.751 |
2 |
7 |
|
D |
107 |
31 |
21778 |
◊ |
A |
x,y,z |
1_555 |
110 |
35 |
21751 |
1041.1 |
-6.8 |
0.382 |
14 |
2 |
0 |
0.081 |
8 |
|
F |
109 |
33 |
21732 |
◊ |
C |
x,y,z |
1_555 |
110 |
34 |
21753 |
1033.9 |
-7.1 |
0.353 |
15 |
2 |
0 |
0.081 |
9 |
|
E |
108 |
34 |
21699 |
◊ |
B |
x,y,z |
1_555 |
109 |
34 |
21655 |
1024.5 |
-7.2 |
0.341 |
14 |
2 |
0 |
0.081 |
Average: |
1033.2 |
-7.0 |
0.359 |
14 |
2 |
0 |
0.081 |
3 |
10 |
|
[NDP]F:551 |
47 |
1 |
916 |
f |
F |
x,y,z |
1_555 |
85 |
31 |
21732 |
651.6 |
-3.1 |
0.539 |
9 |
0 |
0 |
0.218 |
11 |
|
[NDP]E:551 |
47 |
1 |
907 |
f |
E |
x,y,z |
1_555 |
87 |
32 |
21699 |
645.7 |
-3.4 |
0.543 |
10 |
0 |
0 |
0.218 |
12 |
|
[NDP]A:551 |
47 |
1 |
914 |
f |
A |
x,y,z |
1_555 |
87 |
31 |
21751 |
640.4 |
-4.0 |
0.519 |
12 |
0 |
0 |
0.218 |
13 |
|
[NDP]C:551 |
47 |
1 |
918 |
f |
C |
x,y,z |
1_555 |
85 |
30 |
21753 |
640.0 |
-3.1 |
0.534 |
11 |
0 |
0 |
0.218 |
14 |
|
[NDP]D:551 |
47 |
1 |
914 |
f |
D |
x,y,z |
1_555 |
87 |
31 |
21778 |
638.4 |
-3.5 |
0.534 |
11 |
0 |
0 |
0.218 |
15 |
|
[NDP]B:551 |
47 |
1 |
909 |
f |
B |
x,y,z |
1_555 |
89 |
31 |
21655 |
636.3 |
-3.6 |
0.522 |
11 |
0 |
0 |
0.218 |
Average: |
642.1 |
-3.4 |
0.532 |
11 |
0 |
0 |
0.218 |
4 |
16 |
|
[GTP]A:553 |
29 |
1 |
626 |
f |
A |
x,y,z |
1_555 |
37 |
15 |
21751 |
327.4 |
-2.8 |
0.580 |
11 |
0 |
0 |
0.097 |
5 |
17 |
|
E |
31 |
8 |
21699 |
◊ |
A |
x,y,z |
1_555 |
31 |
8 |
21751 |
294.1 |
-0.7 |
0.611 |
2 |
0 |
0 |
0.024 |
18 |
|
F |
31 |
8 |
21732 |
◊ |
D |
x,y,z |
1_555 |
31 |
8 |
21778 |
292.3 |
-0.9 |
0.590 |
2 |
0 |
0 |
0.024 |
19 |
|
C |
31 |
8 |
21753 |
◊ |
B |
x,y,z |
1_555 |
31 |
8 |
21655 |
291.8 |
-0.7 |
0.605 |
2 |
0 |
0 |
0.024 |
Average: |
292.7 |
-0.8 |
0.602 |
2 |
0 |
0 |
0.024 |
6 |
20 |
|
[GTP]C:553 |
20 |
1 |
681 |
f |
C |
x,y,z |
1_555 |
35 |
14 |
21753 |
278.5 |
0.3 |
0.695 |
9 |
0 |
0 |
0.048 |
7 |
21 |
|
[GTP]B:553 |
26 |
1 |
614 |
f |
B |
x,y,z |
1_555 |
32 |
15 |
21655 |
276.0 |
3.0 |
0.845 |
12 |
0 |
0 |
0.031 |
8 |
22 |
|
[GTP]D:553 |
22 |
1 |
644 |
f |
D |
x,y,z |
1_555 |
32 |
14 |
21778 |
267.2 |
3.6 |
0.845 |
9 |
0 |
0 |
0.005 |
9 |
23 |
|
[GTP]E:553 |
22 |
1 |
634 |
f |
E |
x,y,z |
1_555 |
34 |
14 |
21699 |
262.6 |
3.4 |
0.843 |
8 |
0 |
0 |
0.001 |
10 |
24 |
|
[GTP]F:553 |
24 |
1 |
626 |
f |
F |
x,y,z |
1_555 |
33 |
14 |
21732 |
261.8 |
2.2 |
0.804 |
10 |
0 |
0 |
0.031 |
11 |
25 |
|
D |
30 |
11 |
21778 |
◊ |
A |
-x+1,y-1/2,-z+2 |
2_647 |
27 |
8 |
21751 |
232.8 |
-1.5 |
0.479 |
0 |
1 |
0 |
0.000 |
26 |
|
C |
23 |
8 |
21753 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
16 |
6 |
21655 |
156.7 |
-2.4 |
0.286 |
1 |
1 |
0 |
0.000 |
Average: |
194.7 |
-1.9 |
0.383 |
1 |
1 |
0 |
0.000 |
12 |
27 |
|
F |
21 |
8 |
21732 |
◊ |
D |
x-1,y,z |
1_455 |
20 |
5 |
21778 |
187.5 |
-0.0 |
0.633 |
1 |
0 |
0 |
0.000 |
28 |
|
B |
19 |
5 |
21655 |
◊ |
C |
x-1,y,z |
1_455 |
21 |
8 |
21753 |
181.7 |
0.2 |
0.658 |
1 |
0 |
0 |
0.000 |
Average: |
184.6 |
0.1 |
0.646 |
1 |
0 |
0 |
0.000 |
13 |
29 |
|
[H3P]C:554 |
17 |
1 |
502 |
◊ |
C |
x,y,z |
1_555 |
28 |
7 |
21753 |
186.9 |
-15.4 |
0.474 |
0 |
0 |
0 |
0.206 |
30 |
|
[H3P]F:552 |
17 |
1 |
501 |
◊ |
D |
x,y,z |
1_555 |
29 |
8 |
21778 |
183.3 |
-15.0 |
0.477 |
0 |
0 |
0 |
0.206 |
31 |
|
[H3P]A:552 |
17 |
1 |
502 |
◊ |
E |
x,y,z |
1_555 |
27 |
7 |
21699 |
178.5 |
-14.8 |
0.480 |
0 |
0 |
0 |
0.206 |
Average: |
182.9 |
-15.1 |
0.477 |
0 |
0 |
0 |
0.206 |
14 |
32 |
|
C |
18 |
7 |
21753 |
◊ |
E |
x,y-1,z |
1_545 |
27 |
11 |
21699 |
179.1 |
-1.2 |
0.451 |
1 |
0 |
0 |
0.000 |
15 |
33 |
|
[H3P]F:552 |
15 |
1 |
501 |
f |
F |
x,y,z |
1_555 |
27 |
8 |
21732 |
173.4 |
-16.5 |
0.431 |
0 |
0 |
0 |
0.227 |
34 |
|
[H3P]A:552 |
15 |
1 |
502 |
f |
A |
x,y,z |
1_555 |
26 |
8 |
21751 |
168.7 |
-15.8 |
0.451 |
0 |
0 |
0 |
0.227 |
35 |
|
[H3P]C:554 |
15 |
1 |
502 |
f |
B |
x,y,z |
1_555 |
26 |
7 |
21655 |
168.1 |
-15.4 |
0.430 |
0 |
0 |
0 |
0.227 |
Average: |
170.1 |
-15.9 |
0.437 |
0 |
0 |
0 |
0.227 |
16 |
36 |
|
C |
17 |
4 |
21753 |
◊ |
A |
-x+1,y-1/2,-z+2 |
2_647 |
19 |
5 |
21751 |
153.9 |
-0.3 |
0.596 |
0 |
0 |
0 |
0.000 |
17 |
37 |
|
F |
13 |
7 |
21732 |
◊ |
C |
x-1,y,z |
1_455 |
13 |
7 |
21753 |
119.4 |
-1.6 |
0.316 |
0 |
0 |
0 |
0.000 |
18 |
38 |
|
[H3P]B:552 |
10 |
1 |
493 |
f |
B |
x,y,z |
1_555 |
18 |
10 |
21655 |
118.3 |
-12.9 |
0.550 |
0 |
0 |
0 |
0.173 |
39 |
|
[H3P]C:552 |
9 |
1 |
493 |
f |
F |
x,y,z |
1_555 |
16 |
9 |
21732 |
116.6 |
-12.6 |
0.517 |
0 |
0 |
0 |
0.173 |
40 |
|
[H3P]D:552 |
8 |
1 |
494 |
f |
A |
x,y,z |
1_555 |
17 |
9 |
21751 |
111.7 |
-12.1 |
0.512 |
0 |
0 |
0 |
0.173 |
Average: |
115.6 |
-12.5 |
0.526 |
0 |
0 |
0 |
0.173 |
19 |
41 |
|
[H3P]B:552 |
13 |
1 |
493 |
◊ |
A |
x,y,z |
1_555 |
10 |
1 |
21751 |
80.4 |
-6.6 |
0.389 |
0 |
0 |
0 |
0.070 |
42 |
|
[H3P]D:552 |
13 |
1 |
494 |
◊ |
F |
x,y,z |
1_555 |
8 |
1 |
21732 |
77.3 |
-6.3 |
0.349 |
0 |
0 |
0 |
0.070 |
43 |
|
[H3P]C:552 |
12 |
1 |
493 |
◊ |
B |
x,y,z |
1_555 |
8 |
1 |
21655 |
76.2 |
-6.2 |
0.358 |
0 |
0 |
0 |
0.070 |
Average: |
78.0 |
-6.4 |
0.365 |
0 |
0 |
0 |
0.070 |
20 |
44 |
|
[H3P]C:552 |
6 |
1 |
493 |
◊ |
C |
x,y,z |
1_555 |
11 |
5 |
21753 |
75.6 |
-8.3 |
0.486 |
0 |
0 |
0 |
0.043 |
45 |
|
[H3P]D:552 |
5 |
1 |
494 |
◊ |
D |
x,y,z |
1_555 |
11 |
5 |
21778 |
71.0 |
-7.6 |
0.459 |
0 |
0 |
0 |
0.043 |
46 |
|
[H3P]B:552 |
4 |
1 |
493 |
◊ |
E |
x,y,z |
1_555 |
9 |
5 |
21699 |
54.3 |
-5.9 |
0.570 |
0 |
0 |
0 |
0.043 |
Average: |
66.9 |
-7.3 |
0.505 |
0 |
0 |
0 |
0.043 |
21 |
47 |
|
A |
10 |
4 |
21751 |
◊ |
C |
x-1,y,z |
1_455 |
7 |
2 |
21753 |
75.0 |
0.6 |
0.703 |
0 |
1 |
0 |
0.000 |
48 |
|
F |
7 |
2 |
21732 |
◊ |
E |
x-1,y,z |
1_455 |
9 |
4 |
21699 |
72.8 |
0.7 |
0.717 |
0 |
1 |
0 |
0.000 |
Average: |
73.9 |
0.7 |
0.710 |
0 |
1 |
0 |
0.000 |
22 |
49 |
|
[H3P]D:552 |
10 |
1 |
494 |
◊ |
[H3P]F:552 |
x,y,z |
1_555 |
6 |
1 |
501 |
65.8 |
-9.2 |
0.884 |
0 |
0 |
0 |
0.101 |
50 |
|
[H3P]B:552 |
10 |
1 |
493 |
◊ |
[H3P]A:552 |
x,y,z |
1_555 |
6 |
1 |
502 |
65.3 |
-9.0 |
0.885 |
0 |
0 |
0 |
0.101 |
51 |
|
[H3P]C:552 |
10 |
1 |
493 |
◊ |
[H3P]C:554 |
x,y,z |
1_555 |
6 |
1 |
502 |
65.2 |
-9.2 |
0.886 |
0 |
0 |
0 |
0.101 |
Average: |
65.4 |
-9.1 |
0.885 |
0 |
0 |
0 |
0.101 |
23 |
52 |
|
[H3P]D:552 |
11 |
1 |
494 |
f |
[H3P]A:552 |
x,y,z |
1_555 |
11 |
1 |
502 |
61.3 |
-6.2 |
0.974 |
0 |
0 |
0 |
0.079 |
53 |
|
[H3P]C:552 |
7 |
1 |
493 |
f |
[H3P]F:552 |
x,y,z |
1_555 |
10 |
1 |
501 |
52.5 |
-5.6 |
0.934 |
0 |
0 |
0 |
0.079 |
Average: |
56.9 |
-5.9 |
0.954 |
0 |
0 |
0 |
0.079 |
24 |
54 |
|
[H3P]B:552 |
9 |
1 |
493 |
f |
[H3P]C:554 |
x,y,z |
1_555 |
11 |
1 |
502 |
58.2 |
-5.9 |
0.962 |
0 |
0 |
0 |
0.077 |
25 |
55 |
|
F |
7 |
3 |
21732 |
◊ |
D |
-x+1,y-1/2,-z+2 |
2_647 |
11 |
2 |
21778 |
57.5 |
0.3 |
0.671 |
0 |
0 |
0 |
0.000 |
26 |
56 |
|
F |
5 |
1 |
21732 |
◊ |
B |
x,y-1,z |
1_545 |
8 |
2 |
21655 |
54.5 |
-0.5 |
0.488 |
1 |
0 |
0 |
0.000 |
27 |
57 |
|
[H3P]C:552 |
11 |
1 |
493 |
◊ |
D |
x,y,z |
1_555 |
4 |
1 |
21778 |
54.0 |
-3.2 |
0.395 |
0 |
0 |
0 |
0.044 |
58 |
|
[H3P]D:552 |
11 |
1 |
494 |
◊ |
E |
x,y,z |
1_555 |
4 |
1 |
21699 |
52.2 |
-3.3 |
0.394 |
0 |
0 |
0 |
0.044 |
59 |
|
[H3P]B:552 |
10 |
1 |
493 |
◊ |
C |
x,y,z |
1_555 |
4 |
1 |
21753 |
47.1 |
-3.0 |
0.426 |
0 |
0 |
0 |
0.044 |
Average: |
51.1 |
-3.2 |
0.405 |
0 |
0 |
0 |
0.044 |
28 |
60 |
|
E |
7 |
2 |
21699 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
11 |
3 |
21655 |
50.7 |
0.1 |
0.606 |
0 |
0 |
0 |
0.000 |
29 |
61 |
|
F |
5 |
1 |
21732 |
◊ |
A |
x,y-1,z |
1_545 |
7 |
3 |
21751 |
39.6 |
-0.7 |
0.388 |
0 |
0 |
0 |
0.000 |
30 |
62 |
|
B |
5 |
1 |
21655 |
◊ |
D |
x-1,y,z |
1_455 |
5 |
1 |
21778 |
37.3 |
0.5 |
0.762 |
0 |
0 |
0 |
0.000 |
31 |
63 |
|
F |
1 |
1 |
21732 |
◊ |
A |
-x+1,y-1/2,-z+2 |
2_647 |
2 |
1 |
21751 |
1.8 |
-0.0 |
0.524 |
0 |
0 |
0 |
0.000 |
|