## |
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 |
168 |
46 |
11826 |
◊ |
A |
x,y,z |
1_555 |
160 |
37 |
23540 |
1522.0 |
-22.3 |
0.135 |
15 |
5 |
0 |
0.791 |
2 |
|
D |
166 |
46 |
11833 |
◊ |
B |
x,y,z |
1_555 |
163 |
38 |
23572 |
1520.3 |
-23.2 |
0.108 |
15 |
5 |
0 |
0.791 |
Average: |
1521.1 |
-22.7 |
0.122 |
15 |
5 |
0 |
0.791 |
2 |
3 |
|
B |
143 |
38 |
23572 |
◊ |
A |
x,y,z |
1_555 |
144 |
38 |
23540 |
1476.0 |
-16.1 |
0.361 |
20 |
8 |
0 |
1.000 |
3 |
4 |
|
C |
92 |
29 |
11826 |
◊ |
B |
x,y,z |
1_555 |
97 |
29 |
23572 |
816.3 |
2.2 |
0.949 |
9 |
5 |
0 |
0.048 |
5 |
|
D |
92 |
29 |
11833 |
◊ |
A |
x,y,z |
1_555 |
98 |
30 |
23540 |
814.4 |
2.2 |
0.948 |
9 |
5 |
0 |
0.048 |
Average: |
815.4 |
2.2 |
0.948 |
9 |
5 |
0 |
0.048 |
4 |
6 |
|
E |
61 |
6 |
1716 |
◊ |
A |
x,y,z |
1_555 |
63 |
22 |
23540 |
503.2 |
-5.0 |
0.554 |
11 |
0 |
0 |
1.000 |
5 |
7 |
|
G |
58 |
5 |
1737 |
◊ |
B |
x,y,z |
1_555 |
63 |
21 |
23572 |
496.4 |
-6.6 |
0.533 |
11 |
0 |
0 |
1.000 |
6 |
8 |
|
H |
54 |
8 |
2828 |
◊ |
B |
x,y,z |
1_555 |
53 |
19 |
23572 |
467.6 |
-0.2 |
0.775 |
2 |
0 |
0 |
0.049 |
7 |
9 |
|
F |
53 |
8 |
2808 |
◊ |
A |
x,y,z |
1_555 |
54 |
19 |
23540 |
460.0 |
-0.6 |
0.789 |
3 |
0 |
0 |
0.095 |
8 |
10 |
|
H |
40 |
6 |
2828 |
◊ |
D |
x,y,z |
1_555 |
40 |
18 |
11833 |
363.1 |
-7.0 |
0.439 |
7 |
0 |
0 |
0.351 |
9 |
11 |
|
F |
36 |
6 |
2808 |
◊ |
C |
x,y,z |
1_555 |
40 |
17 |
11826 |
359.7 |
-6.6 |
0.463 |
7 |
0 |
0 |
0.366 |
10 |
12 |
|
D |
31 |
6 |
11833 |
◊ |
A |
-y,x-y+1,z-1/3 |
2_564 |
35 |
9 |
23540 |
318.4 |
0.8 |
0.749 |
4 |
7 |
0 |
0.000 |
13 |
|
C |
31 |
6 |
11826 |
◊ |
B |
-y+1,x-y+1,z-1/3 |
2_664 |
33 |
9 |
23572 |
317.7 |
0.8 |
0.738 |
3 |
7 |
0 |
0.000 |
Average: |
318.1 |
0.8 |
0.744 |
4 |
7 |
0 |
0.000 |
11 |
14 |
|
H |
31 |
7 |
2828 |
◊ |
G |
x,y,z |
1_555 |
35 |
7 |
1737 |
316.4 |
-2.7 |
0.578 |
17 |
0 |
0 |
1.000 |
12 |
15 |
|
F |
29 |
7 |
2808 |
◊ |
E |
x,y,z |
1_555 |
33 |
7 |
1716 |
295.0 |
-3.6 |
0.533 |
12 |
0 |
0 |
1.000 |
13 |
16 |
|
H |
18 |
4 |
2828 |
◊ |
F |
x,y,z |
1_555 |
18 |
4 |
2808 |
169.7 |
-4.2 |
0.440 |
9 |
0 |
0 |
0.211 |
14 |
17 |
|
[PDQ]F:0 |
18 |
1 |
546 |
◊ |
F |
x,y,z |
1_555 |
23 |
3 |
2808 |
154.8 |
3.8 |
0.799 |
1 |
0 |
0 |
0.000 |
15 |
18 |
|
[PDQ]H:0 |
18 |
1 |
547 |
◊ |
H |
x,y,z |
1_555 |
25 |
3 |
2828 |
154.6 |
2.8 |
0.770 |
0 |
0 |
0 |
0.000 |
16 |
19 |
|
E |
14 |
2 |
1716 |
◊ |
C |
x,y,z |
1_555 |
14 |
6 |
11826 |
129.1 |
-0.3 |
0.548 |
1 |
0 |
0 |
0.029 |
17 |
20 |
|
[PDQ]H:0 |
9 |
1 |
547 |
f |
D |
x,y,z |
1_555 |
23 |
7 |
11833 |
127.8 |
-1.2 |
0.324 |
2 |
0 |
0 |
0.074 |
21 |
|
[PDQ]F:0 |
9 |
1 |
546 |
f |
C |
x,y,z |
1_555 |
21 |
6 |
11826 |
126.5 |
-1.1 |
0.343 |
2 |
0 |
0 |
0.074 |
Average: |
127.1 |
-1.1 |
0.333 |
2 |
0 |
0 |
0.074 |
18 |
22 |
|
G |
14 |
2 |
1737 |
◊ |
D |
x,y,z |
1_555 |
14 |
6 |
11833 |
125.4 |
-0.4 |
0.563 |
1 |
0 |
0 |
0.030 |
19 |
23 |
|
H |
13 |
2 |
2828 |
◊ |
C |
x,y,z |
1_555 |
21 |
7 |
11826 |
125.1 |
-2.7 |
0.439 |
3 |
0 |
0 |
0.105 |
20 |
24 |
|
F |
15 |
2 |
2808 |
◊ |
D |
x,y,z |
1_555 |
17 |
7 |
11833 |
117.6 |
-3.8 |
0.380 |
2 |
0 |
0 |
0.083 |
21 |
25 |
|
[PDQ]F:0 |
18 |
1 |
546 |
◊ |
H |
x,y,z |
1_555 |
15 |
1 |
2828 |
117.3 |
0.3 |
0.575 |
0 |
0 |
0 |
0.000 |
22 |
26 |
|
[PDQ]H:0 |
18 |
1 |
547 |
◊ |
F |
x,y,z |
1_555 |
15 |
1 |
2808 |
115.9 |
1.9 |
0.680 |
0 |
0 |
0 |
0.000 |
23 |
27 |
|
[PDQ]H:0 |
12 |
1 |
547 |
◊ |
G |
x,y,z |
1_555 |
11 |
2 |
1737 |
71.8 |
-0.0 |
0.520 |
0 |
0 |
0 |
0.000 |
24 |
28 |
|
[PDQ]F:0 |
11 |
1 |
546 |
◊ |
E |
x,y,z |
1_555 |
11 |
2 |
1716 |
70.9 |
-0.2 |
0.489 |
0 |
0 |
0 |
0.006 |
25 |
29 |
|
[PDQ]H:0 |
4 |
1 |
547 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
23540 |
50.6 |
0.9 |
0.664 |
1 |
0 |
0 |
0.000 |
30 |
|
[PDQ]F:0 |
4 |
1 |
546 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
23572 |
48.8 |
0.8 |
0.647 |
1 |
0 |
0 |
0.000 |
Average: |
49.7 |
0.8 |
0.655 |
1 |
0 |
0 |
0.000 |
26 |
31 |
|
[MG]D:742 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
6 |
5 |
11833 |
45.8 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.219 |
32 |
|
[MG]C:742 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
8 |
6 |
11826 |
45.6 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.219 |
Average: |
45.7 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.219 |
27 |
33 |
|
[PDQ]H:0 |
2 |
1 |
547 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
23572 |
24.8 |
0.0 |
0.514 |
0 |
0 |
0 |
0.000 |
34 |
|
[PDQ]F:0 |
2 |
1 |
546 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
23540 |
22.9 |
0.1 |
0.518 |
0 |
0 |
0 |
0.000 |
Average: |
23.9 |
0.0 |
0.516 |
0 |
0 |
0 |
0.000 |
28 |
35 |
|
G |
6 |
1 |
1737 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
23540 |
24.7 |
0.9 |
0.756 |
0 |
0 |
0 |
0.000 |
29 |
36 |
|
E |
6 |
1 |
1716 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
23572 |
24.4 |
0.8 |
0.733 |
0 |
0 |
0 |
0.000 |
30 |
37 |
|
[MG]C:742 |
1 |
1 |
98 |
◊ |
E |
x,y,z |
1_555 |
3 |
1 |
1716 |
19.9 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.099 |
31 |
38 |
|
[MG]D:742 |
1 |
1 |
98 |
◊ |
G |
x,y,z |
1_555 |
3 |
1 |
1737 |
19.2 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.084 |
32 |
39 |
|
C |
2 |
2 |
11826 |
◊ |
A |
-y+1,x-y+1,z-1/3 |
2_664 |
3 |
2 |
23540 |
15.5 |
-0.4 |
0.375 |
0 |
0 |
0 |
0.000 |
40 |
|
D |
2 |
2 |
11833 |
◊ |
B |
-y,x-y+1,z-1/3 |
2_564 |
3 |
2 |
23572 |
15.2 |
-0.4 |
0.377 |
0 |
0 |
0 |
0.000 |
Average: |
15.3 |
-0.4 |
0.376 |
0 |
0 |
0 |
0.000 |
33 |
41 |
|
G |
3 |
1 |
1737 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
2808 |
15.0 |
-0.6 |
0.315 |
0 |
0 |
0 |
0.010 |
34 |
42 |
|
H |
2 |
1 |
2828 |
◊ |
E |
x,y,z |
1_555 |
3 |
1 |
1716 |
12.7 |
-0.2 |
0.412 |
0 |
0 |
0 |
0.006 |
35 |
43 |
|
B |
2 |
2 |
23572 |
◊ |
A |
-y,x-y+1,z-1/3 |
2_564 |
2 |
1 |
23540 |
12.1 |
-0.2 |
0.425 |
0 |
0 |
0 |
0.000 |
44 |
|
A |
2 |
2 |
23540 |
◊ |
B |
-y+1,x-y+1,z-1/3 |
2_664 |
2 |
1 |
23572 |
11.9 |
-0.2 |
0.434 |
0 |
0 |
0 |
0.000 |
Average: |
12.0 |
-0.2 |
0.429 |
0 |
0 |
0 |
0.000 |
36 |
45 |
|
B |
1 |
1 |
23572 |
x |
B |
-y,x-y+1,z-1/3 |
2_564 |
1 |
1 |
23572 |
6.2 |
-0.0 |
0.504 |
0 |
0 |
0 |
0.000 |
46 |
|
A |
1 |
1 |
23540 |
x |
A |
-y+1,x-y+1,z-1/3 |
2_664 |
1 |
1 |
23540 |
6.0 |
-0.0 |
0.509 |
0 |
0 |
0 |
0.000 |
Average: |
6.1 |
-0.0 |
0.507 |
0 |
0 |
0 |
0.000 |
37 |
47 |
|
D |
2 |
1 |
11833 |
x |
D |
-y,x-y+1,z-1/3 |
2_564 |
1 |
1 |
11833 |
6.1 |
-0.0 |
0.609 |
0 |
0 |
0 |
0.000 |
48 |
|
C |
2 |
1 |
11826 |
x |
C |
-y+1,x-y+1,z-1/3 |
2_664 |
1 |
1 |
11826 |
5.5 |
-0.0 |
0.609 |
0 |
0 |
0 |
0.000 |
Average: |
5.8 |
-0.0 |
0.609 |
0 |
0 |
0 |
0.000 |
38 |
49 |
|
[MG]C:742 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
23540 |
2.3 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.005 |
50 |
|
[MG]D:742 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
23572 |
2.1 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.005 |
Average: |
2.2 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.005 |
|