## |
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 |
259 |
75 |
19183 |
◊ |
A |
x,y,z |
1_555 |
258 |
73 |
19218 |
2671.7 |
-10.8 |
0.593 |
47 |
18 |
0 |
1.000 |
2 |
|
F |
251 |
75 |
18913 |
◊ |
B |
x,y,z |
1_555 |
261 |
74 |
19074 |
2593.6 |
-13.1 |
0.535 |
45 |
16 |
0 |
1.000 |
3 |
|
D |
251 |
73 |
18972 |
◊ |
C |
x,y,z |
1_555 |
253 |
73 |
19120 |
2585.6 |
-16.7 |
0.352 |
45 |
15 |
0 |
1.000 |
Average: |
2617.0 |
-13.5 |
0.493 |
46 |
16 |
0 |
1.000 |
2 |
4 |
|
[NAP]B:501 |
46 |
1 |
918 |
f |
B |
x,y,z |
1_555 |
93 |
34 |
19074 |
656.9 |
-4.0 |
0.456 |
12 |
0 |
0 |
0.523 |
5 |
|
[NAP]D:501 |
46 |
1 |
914 |
f |
D |
x,y,z |
1_555 |
90 |
34 |
18972 |
651.6 |
-4.7 |
0.432 |
9 |
0 |
0 |
0.523 |
6 |
|
[NAP]F:501 |
46 |
1 |
917 |
f |
F |
x,y,z |
1_555 |
91 |
34 |
18913 |
651.6 |
-4.0 |
0.477 |
11 |
0 |
0 |
0.523 |
7 |
|
[NAP]E:501 |
45 |
1 |
916 |
f |
E |
x,y,z |
1_555 |
91 |
34 |
19183 |
649.4 |
-5.0 |
0.421 |
7 |
0 |
0 |
0.523 |
8 |
|
[NAP]A:501 |
46 |
1 |
913 |
f |
A |
x,y,z |
1_555 |
92 |
34 |
19218 |
648.6 |
-4.5 |
0.420 |
9 |
0 |
0 |
0.523 |
9 |
|
[NAP]C:501 |
46 |
1 |
914 |
f |
C |
x,y,z |
1_555 |
93 |
35 |
19120 |
647.6 |
-4.7 |
0.408 |
8 |
0 |
0 |
0.523 |
Average: |
651.0 |
-4.5 |
0.436 |
9 |
0 |
0 |
0.523 |
3 |
10 |
|
A |
68 |
18 |
19218 |
◊ |
C |
x-1,y,z-1 |
1_454 |
65 |
19 |
19120 |
591.9 |
-2.0 |
0.575 |
10 |
1 |
0 |
0.000 |
11 |
|
E |
61 |
18 |
19183 |
◊ |
B |
x,y,z-1 |
1_554 |
57 |
18 |
19074 |
537.1 |
-3.4 |
0.442 |
10 |
0 |
0 |
0.000 |
Average: |
564.5 |
-2.7 |
0.508 |
10 |
1 |
0 |
0.000 |
4 |
12 |
|
D |
34 |
10 |
18972 |
◊ |
F |
-x+1,y-1/2,-z+1 |
2_646 |
38 |
12 |
18913 |
348.4 |
0.5 |
0.786 |
6 |
0 |
0 |
0.000 |
5 |
13 |
|
B |
27 |
11 |
19074 |
◊ |
A |
x,y,z |
1_555 |
24 |
10 |
19218 |
259.3 |
-5.1 |
0.061 |
1 |
0 |
0 |
0.000 |
14 |
|
E |
28 |
11 |
19183 |
◊ |
C |
x,y,z |
1_555 |
30 |
14 |
19120 |
249.4 |
-4.5 |
0.118 |
1 |
0 |
0 |
0.000 |
Average: |
254.3 |
-4.8 |
0.090 |
1 |
0 |
0 |
0.000 |
6 |
15 |
|
F |
30 |
10 |
18913 |
◊ |
B |
x-1,y,z |
1_455 |
29 |
9 |
19074 |
224.2 |
-1.0 |
0.548 |
1 |
1 |
0 |
0.000 |
16 |
|
C |
21 |
7 |
19120 |
◊ |
D |
x-1,y,z |
1_455 |
28 |
9 |
18972 |
195.8 |
-0.1 |
0.627 |
3 |
1 |
0 |
0.000 |
Average: |
210.0 |
-0.5 |
0.588 |
2 |
1 |
0 |
0.000 |
7 |
17 |
|
[EDO]D:503 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
21 |
8 |
18972 |
123.6 |
2.6 |
0.358 |
1 |
0 |
0 |
0.000 |
8 |
18 |
|
[EDO]F:502 |
4 |
1 |
182 |
f |
F |
x,y,z |
1_555 |
21 |
9 |
18913 |
120.1 |
2.6 |
0.364 |
1 |
0 |
0 |
0.000 |
9 |
19 |
|
[EDO]B:502 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
20 |
9 |
19074 |
118.3 |
2.8 |
0.366 |
1 |
0 |
0 |
0.000 |
10 |
20 |
|
[EDO]E:502 |
4 |
1 |
184 |
f |
E |
x,y,z |
1_555 |
19 |
9 |
19183 |
112.0 |
2.4 |
0.355 |
1 |
0 |
0 |
0.000 |
11 |
21 |
|
[EDO]E:503 |
4 |
1 |
184 |
f |
E |
x,y,z |
1_555 |
16 |
9 |
19183 |
110.0 |
3.3 |
0.475 |
1 |
0 |
0 |
0.000 |
12 |
22 |
|
A |
17 |
6 |
19218 |
◊ |
D |
x-1,y,z |
1_455 |
14 |
6 |
18972 |
108.1 |
-0.9 |
0.441 |
0 |
0 |
0 |
0.000 |
23 |
|
F |
15 |
6 |
18913 |
◊ |
E |
x-1,y,z |
1_455 |
14 |
5 |
19183 |
84.1 |
-1.4 |
0.385 |
0 |
0 |
0 |
0.000 |
Average: |
96.1 |
-1.2 |
0.413 |
0 |
0 |
0 |
0.000 |
13 |
24 |
|
[EDO]A:505 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
19218 |
105.6 |
2.7 |
0.393 |
1 |
0 |
0 |
0.000 |
14 |
25 |
|
[EDO]F:503 |
4 |
1 |
183 |
f |
F |
x,y,z |
1_555 |
23 |
9 |
18913 |
97.5 |
2.8 |
0.447 |
0 |
0 |
0 |
0.000 |
15 |
26 |
|
[EDO]D:505 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
20 |
9 |
18972 |
96.8 |
2.6 |
0.424 |
0 |
0 |
0 |
0.000 |
16 |
27 |
|
[EDO]A:504 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
20 |
6 |
19218 |
95.8 |
1.3 |
0.212 |
0 |
0 |
0 |
0.000 |
17 |
28 |
|
E |
16 |
6 |
19183 |
◊ |
B |
x,y,z |
1_555 |
16 |
7 |
19074 |
95.0 |
0.4 |
0.737 |
0 |
0 |
0 |
0.000 |
29 |
|
C |
15 |
6 |
19120 |
◊ |
A |
x,y,z |
1_555 |
12 |
5 |
19218 |
86.2 |
0.5 |
0.713 |
0 |
0 |
0 |
0.000 |
Average: |
90.6 |
0.4 |
0.725 |
0 |
0 |
0 |
0.000 |
18 |
30 |
|
[EDO]A:503 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
16 |
6 |
19218 |
92.9 |
2.2 |
0.394 |
1 |
0 |
0 |
0.000 |
19 |
31 |
|
[EDO]A:502 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
19218 |
91.8 |
1.6 |
0.331 |
0 |
0 |
0 |
0.000 |
20 |
32 |
|
[EDO]E:504 |
4 |
1 |
183 |
f |
E |
x,y,z |
1_555 |
18 |
8 |
19183 |
88.6 |
1.3 |
0.211 |
0 |
0 |
0 |
0.000 |
21 |
33 |
|
[EDO]D:502 |
4 |
1 |
183 |
f |
D |
x,y,z |
1_555 |
11 |
5 |
18972 |
79.6 |
1.6 |
0.210 |
2 |
0 |
0 |
0.000 |
22 |
34 |
|
D |
12 |
4 |
18972 |
◊ |
B |
-x+2,y-1/2,-z+2 |
2_747 |
8 |
4 |
19074 |
72.2 |
0.5 |
0.702 |
0 |
0 |
0 |
0.000 |
35 |
|
C |
9 |
3 |
19120 |
◊ |
F |
-x+1,y-1/2,-z+2 |
2_647 |
6 |
3 |
18913 |
50.4 |
-0.5 |
0.409 |
0 |
0 |
0 |
0.000 |
Average: |
61.3 |
-0.0 |
0.556 |
0 |
0 |
0 |
0.000 |
23 |
36 |
|
[EDO]D:504 |
4 |
1 |
183 |
f |
D |
x,y,z |
1_555 |
5 |
3 |
18972 |
64.1 |
1.2 |
0.136 |
0 |
0 |
0 |
0.000 |
24 |
37 |
|
[EDO]D:502 |
3 |
1 |
183 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
19120 |
53.7 |
0.7 |
0.109 |
0 |
0 |
0 |
0.000 |
25 |
38 |
|
[EDO]A:503 |
3 |
1 |
186 |
f |
E |
x,y,z |
1_555 |
5 |
3 |
19183 |
47.6 |
0.6 |
0.492 |
0 |
0 |
0 |
0.000 |
26 |
39 |
|
[EDO]A:504 |
4 |
1 |
184 |
f |
[NAP]A:501 |
x,y,z |
1_555 |
3 |
1 |
913 |
44.4 |
1.7 |
0.845 |
0 |
0 |
0 |
0.000 |
27 |
40 |
|
[MG]C:502 |
1 |
1 |
98 |
f |
[NAP]C:501 |
x,y,z |
1_555 |
10 |
1 |
914 |
43.7 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.114 |
41 |
|
[MG]B:503 |
1 |
1 |
98 |
f |
[NAP]B:501 |
x,y,z |
1_555 |
5 |
1 |
918 |
43.4 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.114 |
Average: |
43.5 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.114 |
28 |
42 |
|
[EDO]D:504 |
3 |
1 |
183 |
f |
[NAP]D:501 |
x,y,z |
1_555 |
6 |
1 |
914 |
37.3 |
-0.5 |
0.516 |
1 |
0 |
0 |
0.032 |
29 |
43 |
|
F |
5 |
2 |
18913 |
◊ |
D |
x-1,y,z |
1_455 |
5 |
2 |
18972 |
34.6 |
0.4 |
0.745 |
0 |
0 |
0 |
0.000 |
30 |
44 |
|
[EDO]E:504 |
3 |
1 |
183 |
f |
[EDO]E:502 |
x,y,z |
1_555 |
2 |
1 |
184 |
27.5 |
1.5 |
1.000 |
0 |
0 |
0 |
0.000 |
31 |
45 |
|
[MG]B:503 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
3 |
3 |
19074 |
24.1 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.042 |
46 |
|
[MG]C:502 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
4 |
3 |
19120 |
21.4 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.042 |
Average: |
22.7 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.042 |
32 |
47 |
|
C |
3 |
2 |
19120 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
19074 |
10.2 |
0.1 |
0.689 |
0 |
0 |
0 |
0.000 |
33 |
48 |
|
[EDO]B:502 |
2 |
1 |
184 |
f |
[NAP]B:501 |
x,y,z |
1_555 |
2 |
1 |
918 |
10.2 |
0.4 |
0.700 |
0 |
0 |
0 |
0.000 |
34 |
49 |
|
D |
2 |
2 |
18972 |
◊ |
F |
-x+2,y-1/2,-z+2 |
2_747 |
1 |
1 |
18913 |
6.1 |
0.0 |
0.644 |
0 |
0 |
0 |
0.000 |
50 |
|
D |
1 |
1 |
18972 |
◊ |
F |
-x+1,y-1/2,-z+2 |
2_647 |
1 |
1 |
18913 |
4.6 |
-0.0 |
0.516 |
0 |
0 |
0 |
0.000 |
Average: |
5.3 |
0.0 |
0.580 |
0 |
0 |
0 |
0.000 |
35 |
51 |
|
[EDO]E:502 |
2 |
1 |
184 |
f |
[NAP]E:501 |
x,y,z |
1_555 |
2 |
1 |
916 |
5.4 |
0.2 |
0.707 |
0 |
0 |
0 |
0.000 |
36 |
52 |
|
F |
2 |
2 |
18913 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
19218 |
3.3 |
0.1 |
0.707 |
0 |
0 |
0 |
0.000 |
53 |
|
E |
1 |
1 |
19183 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
18972 |
2.1 |
0.1 |
0.752 |
0 |
0 |
0 |
0.000 |
Average: |
2.7 |
0.1 |
0.729 |
0 |
0 |
0 |
0.000 |
37 |
54 |
|
[EDO]F:502 |
2 |
1 |
182 |
f |
[NAP]F:501 |
x,y,z |
1_555 |
1 |
1 |
917 |
1.4 |
0.1 |
0.722 |
0 |
0 |
0 |
0.000 |
38 |
55 |
|
E |
2 |
2 |
19183 |
◊ |
C |
x,y,z-1 |
1_554 |
1 |
1 |
19120 |
1.2 |
0.0 |
0.685 |
0 |
0 |
0 |
0.000 |
|