## |
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 |
134 |
33 |
12521 |
◊ |
A |
x,y,z |
1_555 |
177 |
46 |
17447 |
1511.8 |
-16.5 |
0.198 |
16 |
5 |
0 |
0.453 |
2 |
2 |
|
D |
146 |
39 |
17189 |
◊ |
C |
x,y,z |
1_555 |
151 |
39 |
17764 |
1345.6 |
-10.5 |
0.282 |
7 |
6 |
0 |
0.325 |
3 |
|
B |
135 |
35 |
17382 |
◊ |
A |
x,y,z |
1_555 |
144 |
34 |
17447 |
1274.7 |
-11.3 |
0.184 |
3 |
9 |
0 |
0.325 |
Average: |
1310.1 |
-10.9 |
0.233 |
5 |
8 |
0 |
0.325 |
3 |
4 |
|
B |
95 |
24 |
17382 |
◊ |
C |
x,y,z |
1_555 |
108 |
30 |
17764 |
858.1 |
-9.4 |
0.174 |
7 |
2 |
0 |
0.080 |
4 |
5 |
|
F |
80 |
23 |
16782 |
◊ |
A |
x,y,z |
1_555 |
86 |
23 |
17447 |
798.0 |
0.7 |
0.679 |
7 |
8 |
0 |
0.000 |
5 |
6 |
|
E |
76 |
16 |
12521 |
◊ |
C |
x,y,z |
1_555 |
84 |
24 |
17764 |
765.7 |
-9.2 |
0.209 |
5 |
4 |
0 |
0.191 |
6 |
7 |
|
F |
85 |
26 |
16782 |
◊ |
D |
-x,y-1/2,-z-1/2 |
3_544 |
88 |
26 |
17189 |
757.5 |
3.3 |
0.782 |
3 |
1 |
0 |
0.000 |
7 |
8 |
|
E |
56 |
16 |
12521 |
◊ |
D |
x,y,z |
1_555 |
84 |
24 |
17189 |
663.2 |
-3.6 |
0.559 |
4 |
5 |
0 |
0.097 |
8 |
9 |
|
E |
60 |
15 |
12521 |
◊ |
B |
x,y,z |
1_555 |
80 |
21 |
17382 |
638.3 |
-1.1 |
0.685 |
3 |
5 |
0 |
0.020 |
9 |
10 |
|
C |
72 |
21 |
17764 |
◊ |
E |
x-1/2,-y-1/2,-z |
4_445 |
50 |
12 |
12521 |
569.8 |
-3.7 |
0.518 |
0 |
2 |
0 |
0.000 |
10 |
11 |
|
F |
49 |
13 |
16782 |
◊ |
B |
x,y,z |
1_555 |
50 |
13 |
17382 |
465.9 |
0.9 |
0.663 |
2 |
1 |
0 |
0.000 |
11 |
12 |
|
[ACP]F:401 |
31 |
1 |
607 |
f |
F |
x,y,z |
1_555 |
54 |
20 |
16782 |
416.8 |
-0.3 |
0.574 |
5 |
0 |
0 |
0.100 |
12 |
13 |
|
[GTP]C:501 |
32 |
1 |
631 |
f |
C |
x,y,z |
1_555 |
62 |
30 |
17764 |
415.3 |
-2.8 |
0.560 |
10 |
0 |
0 |
0.162 |
14 |
|
[GTP]A:501 |
32 |
1 |
627 |
f |
A |
x,y,z |
1_555 |
62 |
28 |
17447 |
411.6 |
-3.0 |
0.534 |
9 |
0 |
0 |
0.162 |
Average: |
413.4 |
-2.9 |
0.547 |
10 |
0 |
0 |
0.162 |
13 |
15 |
|
[GDP]D:501 |
28 |
1 |
562 |
f |
D |
x,y,z |
1_555 |
61 |
28 |
17189 |
410.5 |
-7.9 |
0.501 |
7 |
0 |
0 |
0.246 |
16 |
|
[GDP]B:501 |
27 |
1 |
556 |
f |
B |
x,y,z |
1_555 |
67 |
28 |
17382 |
403.5 |
-6.9 |
0.547 |
7 |
0 |
0 |
0.246 |
Average: |
407.0 |
-7.4 |
0.524 |
7 |
0 |
0 |
0.246 |
14 |
17 |
|
[TIV]B:504 |
28 |
1 |
554 |
f |
B |
x,y,z |
1_555 |
60 |
24 |
17382 |
377.3 |
-2.4 |
0.226 |
1 |
0 |
0 |
0.055 |
18 |
|
[TIV]D:502 |
27 |
1 |
552 |
f |
D |
x,y,z |
1_555 |
50 |
20 |
17189 |
364.6 |
-2.0 |
0.248 |
1 |
0 |
0 |
0.055 |
Average: |
370.9 |
-2.2 |
0.237 |
1 |
0 |
0 |
0.055 |
15 |
19 |
|
A |
39 |
10 |
17447 |
◊ |
C |
-x,y-1/2,-z-1/2 |
3_544 |
50 |
12 |
17764 |
343.9 |
0.6 |
0.760 |
3 |
2 |
0 |
0.000 |
16 |
20 |
|
A |
36 |
13 |
17447 |
◊ |
C |
-x+1/2,-y-1,z-1/2 |
2_544 |
34 |
13 |
17764 |
306.6 |
-1.6 |
0.464 |
1 |
0 |
0 |
0.000 |
17 |
21 |
|
E |
29 |
6 |
12521 |
◊ |
C |
-x+1/2,-y-1,z-1/2 |
2_544 |
37 |
12 |
17764 |
254.6 |
-0.9 |
0.602 |
1 |
0 |
0 |
0.000 |
18 |
22 |
|
C |
24 |
6 |
17764 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
31 |
10 |
17382 |
205.9 |
-0.7 |
0.529 |
1 |
1 |
0 |
0.000 |
19 |
23 |
|
[MES]B:503 |
12 |
1 |
336 |
◊ |
B |
x,y,z |
1_555 |
32 |
12 |
17382 |
199.4 |
8.1 |
0.431 |
0 |
0 |
0 |
0.000 |
20 |
24 |
|
B |
23 |
8 |
17382 |
◊ |
E |
x-1/2,-y-1/2,-z |
4_445 |
30 |
9 |
12521 |
192.3 |
-0.4 |
0.669 |
0 |
2 |
0 |
0.000 |
21 |
25 |
|
B |
23 |
5 |
17382 |
◊ |
D |
x-1/2,-y-1/2,-z |
4_445 |
29 |
8 |
17189 |
192.1 |
-0.9 |
0.530 |
0 |
0 |
0 |
0.000 |
22 |
26 |
|
[GOL]A:504 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
19 |
9 |
17447 |
129.7 |
-0.1 |
0.572 |
0 |
0 |
0 |
0.003 |
23 |
27 |
|
D |
12 |
4 |
17189 |
◊ |
E |
x-1/2,-y-1/2,-z |
4_445 |
11 |
6 |
12521 |
111.2 |
2.1 |
0.851 |
2 |
3 |
0 |
0.000 |
24 |
28 |
|
[TIV]B:504 |
11 |
1 |
554 |
◊ |
A |
x,y,z |
1_555 |
18 |
6 |
17447 |
91.0 |
0.3 |
0.509 |
0 |
0 |
0 |
0.000 |
29 |
|
[TIV]D:502 |
10 |
1 |
552 |
◊ |
C |
x,y,z |
1_555 |
17 |
5 |
17764 |
87.7 |
0.3 |
0.526 |
0 |
0 |
0 |
0.000 |
Average: |
89.4 |
0.3 |
0.518 |
0 |
0 |
0 |
0.000 |
25 |
30 |
|
[MG]B:502 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
5 |
3 |
17382 |
48.1 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.030 |
26 |
31 |
|
C |
6 |
3 |
17764 |
x |
C |
x-1/2,-y-1/2,-z |
4_445 |
12 |
5 |
17764 |
47.4 |
-0.9 |
0.343 |
0 |
0 |
0 |
0.000 |
27 |
32 |
|
[MG]A:502 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
17447 |
44.0 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.113 |
33 |
|
[MG]C:502 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
11 |
6 |
17764 |
43.4 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.113 |
Average: |
43.7 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.113 |
28 |
34 |
|
[CA]A:503 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
5 |
5 |
17447 |
43.1 |
-13.0 |
0.000 |
0 |
0 |
0 |
0.242 |
29 |
35 |
|
[MG]C:502 |
1 |
1 |
98 |
f |
[GTP]C:501 |
x,y,z |
1_555 |
5 |
1 |
631 |
33.4 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.100 |
36 |
|
[MG]A:502 |
1 |
1 |
98 |
f |
[GTP]A:501 |
x,y,z |
1_555 |
6 |
1 |
627 |
32.7 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.100 |
Average: |
33.0 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.100 |
30 |
37 |
|
[GTP]A:501 |
3 |
1 |
627 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
17382 |
31.2 |
0.8 |
0.748 |
1 |
0 |
0 |
0.000 |
38 |
|
[GTP]C:501 |
5 |
1 |
631 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
17189 |
31.1 |
0.7 |
0.757 |
1 |
0 |
0 |
0.000 |
Average: |
31.2 |
0.7 |
0.753 |
1 |
0 |
0 |
0.000 |
31 |
39 |
|
[GDP]B:501 |
7 |
1 |
556 |
f |
[MG]B:502 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.8 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.027 |
32 |
40 |
|
[MES]B:503 |
4 |
1 |
336 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
17447 |
30.2 |
0.1 |
0.074 |
0 |
0 |
0 |
0.000 |
33 |
41 |
|
F |
5 |
3 |
16782 |
◊ |
B |
-x+1/2,-y-1,z-1/2 |
2_544 |
1 |
1 |
17382 |
21.4 |
-0.2 |
0.238 |
0 |
0 |
0 |
0.000 |
34 |
42 |
|
E |
3 |
2 |
12521 |
◊ |
B |
-x+1/2,-y-1,z-1/2 |
2_544 |
2 |
2 |
17382 |
17.6 |
-0.3 |
0.369 |
0 |
0 |
0 |
0.000 |
35 |
43 |
|
F |
5 |
2 |
16782 |
◊ |
A |
-x+1/2,-y-1,z-1/2 |
2_544 |
2 |
2 |
17447 |
14.8 |
-0.2 |
0.443 |
0 |
0 |
0 |
0.000 |
36 |
44 |
|
[MG]A:502 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
17382 |
11.3 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.011 |
45 |
|
[MG]C:502 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
17189 |
10.9 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.011 |
Average: |
11.1 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.011 |
37 |
46 |
|
[MG]B:502 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
17764 |
11.0 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.005 |
38 |
47 |
|
D |
3 |
2 |
17189 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
2 |
2 |
17447 |
9.2 |
0.2 |
0.624 |
0 |
0 |
0 |
0.000 |
39 |
48 |
|
[MES]B:503 |
2 |
1 |
336 |
f |
E |
x,y,z |
1_555 |
1 |
1 |
12521 |
3.0 |
0.1 |
0.164 |
0 |
0 |
0 |
0.000 |
|