## |
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 |
|
C |
211 |
57 |
22748 |
◊ |
A |
x,y,z |
1_555 |
213 |
58 |
22551 |
2049.4 |
-2.2 |
0.540 |
24 |
5 |
0 |
0.279 |
2 |
|
D |
212 |
59 |
22666 |
◊ |
B |
x,y,z |
1_555 |
209 |
59 |
22572 |
2033.7 |
-3.3 |
0.511 |
29 |
6 |
0 |
0.279 |
Average: |
2041.6 |
-2.8 |
0.525 |
27 |
6 |
0 |
0.279 |
2 |
3 |
|
C |
198 |
51 |
22748 |
◊ |
B |
x,y,z |
1_555 |
191 |
48 |
22572 |
1765.5 |
-11.6 |
0.162 |
23 |
0 |
0 |
0.310 |
4 |
|
D |
195 |
48 |
22666 |
◊ |
A |
x,y,z |
1_555 |
194 |
49 |
22551 |
1749.0 |
-11.5 |
0.173 |
20 |
0 |
0 |
0.310 |
Average: |
1757.2 |
-11.5 |
0.167 |
22 |
0 |
0 |
0.310 |
3 |
5 |
|
B |
50 |
15 |
22572 |
◊ |
A |
x,y,z |
1_555 |
54 |
15 |
22551 |
436.3 |
-3.5 |
0.299 |
1 |
3 |
0 |
0.045 |
6 |
|
D |
52 |
16 |
22666 |
◊ |
C |
x,y,z |
1_555 |
52 |
16 |
22748 |
421.4 |
-3.6 |
0.290 |
0 |
3 |
0 |
0.045 |
Average: |
428.8 |
-3.6 |
0.294 |
1 |
3 |
0 |
0.045 |
4 |
7 |
|
A |
36 |
12 |
22551 |
x |
A |
-x+3,y-1/2,-z+3 |
2_848 |
36 |
10 |
22551 |
389.3 |
-2.3 |
0.300 |
3 |
1 |
0 |
0.000 |
5 |
8 |
|
[F6G]B:704 |
28 |
1 |
558 |
f |
B |
x,y,z |
1_555 |
54 |
21 |
22572 |
387.0 |
-0.5 |
0.635 |
12 |
0 |
0 |
0.235 |
9 |
|
[F6G]C:701 |
28 |
1 |
550 |
f |
C |
x,y,z |
1_555 |
52 |
20 |
22748 |
380.6 |
-2.9 |
0.422 |
11 |
0 |
0 |
0.235 |
10 |
|
[F6G]A:703 |
28 |
1 |
544 |
f |
A |
x,y,z |
1_555 |
49 |
19 |
22551 |
379.4 |
-1.3 |
0.584 |
12 |
0 |
0 |
0.235 |
11 |
|
[F6G]D:701 |
28 |
1 |
549 |
f |
D |
x,y,z |
1_555 |
54 |
20 |
22666 |
375.3 |
-2.1 |
0.525 |
11 |
0 |
0 |
0.235 |
Average: |
380.6 |
-1.7 |
0.541 |
12 |
0 |
0 |
0.235 |
6 |
12 |
|
C |
38 |
14 |
22748 |
◊ |
D |
x,y,z-1 |
1_554 |
42 |
11 |
22666 |
364.7 |
2.2 |
0.749 |
6 |
5 |
0 |
0.000 |
7 |
13 |
|
B |
29 |
10 |
22572 |
◊ |
A |
x-1,y,z-1 |
1_454 |
36 |
12 |
22551 |
264.7 |
4.0 |
0.869 |
5 |
2 |
0 |
0.000 |
8 |
14 |
|
[GTP]B:705 |
26 |
1 |
589 |
f |
B |
x,y,z |
1_555 |
36 |
13 |
22572 |
221.9 |
0.2 |
0.627 |
4 |
0 |
0 |
0.077 |
15 |
|
[GTP]D:702 |
26 |
1 |
590 |
f |
D |
x,y,z |
1_555 |
34 |
12 |
22666 |
221.1 |
0.6 |
0.643 |
4 |
0 |
0 |
0.077 |
16 |
|
[GTP]A:704 |
26 |
1 |
588 |
f |
A |
x,y,z |
1_555 |
34 |
12 |
22551 |
218.7 |
0.2 |
0.595 |
6 |
0 |
0 |
0.077 |
17 |
|
[GTP]B:703 |
25 |
1 |
587 |
f |
C |
x,y,z |
1_555 |
34 |
12 |
22748 |
213.6 |
-0.5 |
0.530 |
4 |
0 |
0 |
0.077 |
Average: |
218.8 |
0.1 |
0.599 |
5 |
0 |
0 |
0.077 |
9 |
18 |
|
[GTP]A:704 |
22 |
1 |
588 |
◊ |
D |
x,y,z |
1_555 |
26 |
11 |
22666 |
207.0 |
1.3 |
0.668 |
7 |
0 |
0 |
0.053 |
19 |
|
[GTP]B:705 |
22 |
1 |
589 |
◊ |
C |
x,y,z |
1_555 |
24 |
11 |
22748 |
206.4 |
1.3 |
0.694 |
7 |
0 |
0 |
0.053 |
20 |
|
[GTP]D:702 |
20 |
1 |
590 |
◊ |
A |
x,y,z |
1_555 |
22 |
11 |
22551 |
205.6 |
1.3 |
0.690 |
7 |
0 |
0 |
0.053 |
21 |
|
[GTP]B:703 |
20 |
1 |
587 |
◊ |
B |
x,y,z |
1_555 |
23 |
11 |
22572 |
204.8 |
1.2 |
0.682 |
7 |
0 |
0 |
0.053 |
Average: |
205.9 |
1.3 |
0.684 |
7 |
0 |
0 |
0.053 |
10 |
22 |
|
[F6G]A:701 |
21 |
1 |
577 |
f |
C |
x,y,z |
1_555 |
23 |
10 |
22748 |
177.6 |
0.1 |
0.557 |
3 |
0 |
0 |
0.054 |
23 |
|
[F6G]C:703 |
21 |
1 |
578 |
f |
A |
x,y,z |
1_555 |
23 |
10 |
22551 |
177.6 |
-0.1 |
0.578 |
4 |
0 |
0 |
0.054 |
24 |
|
[F6G]B:701 |
22 |
1 |
578 |
f |
D |
x,y,z |
1_555 |
23 |
10 |
22666 |
175.9 |
0.1 |
0.579 |
4 |
0 |
0 |
0.054 |
25 |
|
[F6G]D:703 |
22 |
1 |
578 |
f |
B |
x,y,z |
1_555 |
23 |
10 |
22572 |
175.5 |
-0.3 |
0.549 |
3 |
0 |
0 |
0.054 |
Average: |
176.7 |
-0.0 |
0.566 |
4 |
0 |
0 |
0.054 |
11 |
26 |
|
[F6G]D:703 |
19 |
1 |
578 |
◊ |
D |
x,y,z |
1_555 |
18 |
7 |
22666 |
164.7 |
0.9 |
0.654 |
6 |
0 |
0 |
0.048 |
27 |
|
[F6G]A:701 |
19 |
1 |
577 |
◊ |
A |
x,y,z |
1_555 |
20 |
7 |
22551 |
164.7 |
1.2 |
0.651 |
6 |
0 |
0 |
0.048 |
28 |
|
[F6G]C:703 |
19 |
1 |
578 |
◊ |
C |
x,y,z |
1_555 |
19 |
8 |
22748 |
164.1 |
1.4 |
0.688 |
6 |
0 |
0 |
0.048 |
29 |
|
[F6G]B:701 |
18 |
1 |
578 |
◊ |
B |
x,y,z |
1_555 |
20 |
7 |
22572 |
163.3 |
1.5 |
0.675 |
6 |
0 |
0 |
0.048 |
Average: |
164.2 |
1.2 |
0.667 |
6 |
0 |
0 |
0.048 |
12 |
30 |
|
B |
16 |
8 |
22572 |
◊ |
C |
x-1,y,z |
1_455 |
25 |
8 |
22748 |
157.3 |
1.6 |
0.761 |
2 |
0 |
0 |
0.000 |
13 |
31 |
|
B |
14 |
5 |
22572 |
◊ |
D |
-x+2,y-1/2,-z+3 |
2_748 |
20 |
6 |
22666 |
141.3 |
2.0 |
0.783 |
4 |
6 |
0 |
0.000 |
14 |
32 |
|
D |
18 |
6 |
22666 |
◊ |
C |
x-1,y,z |
1_455 |
12 |
3 |
22748 |
105.7 |
-0.2 |
0.548 |
0 |
0 |
0 |
0.000 |
15 |
33 |
|
[F6G]A:701 |
13 |
1 |
577 |
◊ |
B |
x,y,z |
1_555 |
17 |
5 |
22572 |
100.5 |
0.1 |
0.528 |
2 |
0 |
0 |
0.028 |
34 |
|
[F6G]C:703 |
14 |
1 |
578 |
◊ |
D |
x,y,z |
1_555 |
17 |
5 |
22666 |
98.4 |
0.4 |
0.575 |
3 |
0 |
0 |
0.028 |
35 |
|
[F6G]B:701 |
14 |
1 |
578 |
◊ |
A |
x,y,z |
1_555 |
16 |
5 |
22551 |
98.0 |
-0.1 |
0.502 |
2 |
0 |
0 |
0.028 |
36 |
|
[F6G]D:703 |
14 |
1 |
578 |
◊ |
C |
x,y,z |
1_555 |
15 |
5 |
22748 |
97.6 |
0.5 |
0.579 |
3 |
0 |
0 |
0.028 |
Average: |
98.6 |
0.2 |
0.546 |
3 |
0 |
0 |
0.028 |
16 |
37 |
|
[GTP]D:702 |
11 |
1 |
590 |
f |
[F6G]B:701 |
x,y,z |
1_555 |
12 |
1 |
578 |
93.8 |
-2.6 |
0.324 |
0 |
0 |
0 |
0.081 |
38 |
|
[GTP]B:703 |
10 |
1 |
587 |
f |
[F6G]A:701 |
x,y,z |
1_555 |
12 |
1 |
577 |
92.7 |
-2.2 |
0.343 |
0 |
0 |
0 |
0.081 |
39 |
|
[GTP]B:705 |
11 |
1 |
589 |
f |
[F6G]D:703 |
x,y,z |
1_555 |
13 |
1 |
578 |
92.5 |
-2.3 |
0.358 |
0 |
0 |
0 |
0.081 |
40 |
|
[GTP]A:704 |
11 |
1 |
588 |
f |
[F6G]C:703 |
x,y,z |
1_555 |
13 |
1 |
578 |
92.4 |
-2.4 |
0.339 |
0 |
0 |
0 |
0.081 |
Average: |
92.8 |
-2.4 |
0.341 |
0 |
0 |
0 |
0.081 |
17 |
41 |
|
D |
8 |
5 |
22666 |
x |
D |
-x+2,y-1/2,-z+3 |
2_748 |
14 |
3 |
22666 |
85.0 |
-1.3 |
0.178 |
0 |
0 |
0 |
0.000 |
18 |
42 |
|
B |
7 |
3 |
22572 |
◊ |
C |
-x+2,y-1/2,-z+2 |
2_747 |
7 |
4 |
22748 |
49.9 |
0.1 |
0.602 |
0 |
0 |
0 |
0.000 |
19 |
43 |
|
[GTP]D:702 |
5 |
1 |
590 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
22572 |
38.2 |
1.3 |
0.716 |
3 |
0 |
0 |
0.000 |
44 |
|
[GTP]B:703 |
5 |
1 |
587 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
22551 |
37.0 |
1.1 |
0.714 |
2 |
0 |
0 |
0.000 |
45 |
|
[GTP]A:704 |
5 |
1 |
588 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
22748 |
36.3 |
1.2 |
0.706 |
2 |
0 |
0 |
0.000 |
46 |
|
[GTP]B:705 |
4 |
1 |
589 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
22666 |
32.5 |
1.5 |
0.716 |
2 |
0 |
0 |
0.000 |
Average: |
36.0 |
1.3 |
0.713 |
2 |
0 |
0 |
0.000 |
20 |
47 |
|
D |
5 |
2 |
22666 |
◊ |
A |
x-1,y,z |
1_455 |
4 |
1 |
22551 |
31.7 |
0.5 |
0.731 |
0 |
0 |
0 |
0.000 |
21 |
48 |
|
[MG]C:702 |
1 |
1 |
98 |
f |
[GTP]B:705 |
x,y,z |
1_555 |
5 |
1 |
589 |
31.7 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.152 |
49 |
|
[MG]C:704 |
1 |
1 |
98 |
f |
[GTP]A:704 |
x,y,z |
1_555 |
5 |
1 |
588 |
31.1 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.152 |
50 |
|
[MG]A:702 |
1 |
1 |
98 |
f |
[GTP]B:703 |
x,y,z |
1_555 |
5 |
1 |
587 |
30.2 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.152 |
51 |
|
[MG]B:702 |
1 |
1 |
98 |
f |
[GTP]D:702 |
x,y,z |
1_555 |
5 |
1 |
590 |
30.1 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.152 |
Average: |
30.8 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.152 |
22 |
52 |
|
[MG]A:702 |
1 |
1 |
98 |
f |
[F6G]A:701 |
x,y,z |
1_555 |
3 |
1 |
577 |
27.4 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.115 |
53 |
|
[MG]C:702 |
1 |
1 |
98 |
f |
[F6G]D:703 |
x,y,z |
1_555 |
4 |
1 |
578 |
27.2 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.115 |
54 |
|
[MG]C:704 |
1 |
1 |
98 |
f |
[F6G]C:703 |
x,y,z |
1_555 |
4 |
1 |
578 |
27.1 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.115 |
55 |
|
[MG]B:702 |
1 |
1 |
98 |
f |
[F6G]B:701 |
x,y,z |
1_555 |
4 |
1 |
578 |
26.6 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.115 |
Average: |
27.1 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.115 |
23 |
56 |
|
[MG]C:704 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
22666 |
15.5 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.018 |
57 |
|
[MG]C:702 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
22748 |
15.0 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.018 |
58 |
|
[MG]B:702 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
22551 |
14.3 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.018 |
59 |
|
[MG]A:702 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
22572 |
13.4 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.018 |
Average: |
14.6 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.018 |
24 |
60 |
|
[MG]C:704 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
22748 |
14.6 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.020 |
61 |
|
[MG]B:702 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
22572 |
14.6 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.020 |
62 |
|
[MG]A:702 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
22551 |
13.0 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.020 |
63 |
|
[MG]C:702 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
22666 |
11.9 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.020 |
Average: |
13.5 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.020 |
25 |
64 |
|
[MG]A:702 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
2 |
2 |
22748 |
7.0 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.016 |
65 |
|
[MG]B:702 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
2 |
2 |
22666 |
7.0 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.016 |
66 |
|
[MG]C:702 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
2 |
2 |
22572 |
4.8 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.016 |
67 |
|
[MG]C:704 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
2 |
2 |
22551 |
3.1 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.016 |
Average: |
5.5 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.016 |
|