## |
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 |
|
B |
241 |
64 |
9230 |
◊ |
A |
x,y,z |
1_555 |
226 |
58 |
8060 |
2117.3 |
-30.0 |
0.251 |
22 |
1 |
0 |
0.374 |
2 |
2 |
|
D |
208 |
52 |
9641 |
◊ |
C |
x,y,z |
1_555 |
188 |
46 |
6457 |
1807.3 |
-25.4 |
0.279 |
25 |
2 |
0 |
0.374 |
3 |
3 |
|
C |
73 |
24 |
6457 |
◊ |
A |
x,y,z |
1_555 |
72 |
23 |
8060 |
709.7 |
-5.8 |
0.710 |
7 |
0 |
0 |
0.215 |
4 |
4 |
|
D |
75 |
22 |
9641 |
◊ |
A |
x,y,z |
1_555 |
72 |
17 |
8060 |
618.2 |
-2.9 |
0.759 |
5 |
2 |
0 |
0.022 |
5 |
5 |
|
[CYC]B:203 |
42 |
1 |
912 |
cf |
B |
x,y,z |
1_555 |
72 |
26 |
9230 |
566.8 |
-13.9 |
0.680 |
5 |
0 |
0 |
0.174 |
6 |
|
[CYC]D:203 |
42 |
1 |
911 |
cf |
D |
x,y,z |
1_555 |
73 |
24 |
9641 |
565.2 |
-14.0 |
0.668 |
7 |
0 |
0 |
0.174 |
Average: |
566.0 |
-14.0 |
0.674 |
6 |
0 |
0 |
0.174 |
6 |
7 |
|
[CYC]D:202 |
41 |
1 |
893 |
cf |
D |
x,y,z |
1_555 |
62 |
21 |
9641 |
477.9 |
-9.6 |
0.704 |
5 |
0 |
0 |
0.120 |
8 |
|
[CYC]B:202 |
42 |
1 |
897 |
cf |
B |
x,y,z |
1_555 |
61 |
19 |
9230 |
475.5 |
-9.4 |
0.680 |
5 |
0 |
0 |
0.120 |
Average: |
476.7 |
-9.5 |
0.692 |
5 |
0 |
0 |
0.120 |
7 |
9 |
|
[M1V]A:101 |
38 |
1 |
906 |
cf |
A |
x,y,z |
1_555 |
55 |
16 |
8060 |
460.4 |
-8.8 |
0.693 |
4 |
0 |
0 |
0.254 |
8 |
10 |
|
[M1V]C:101 |
38 |
1 |
905 |
cf |
C |
x,y,z |
1_555 |
61 |
15 |
6457 |
442.0 |
-9.0 |
0.694 |
5 |
0 |
0 |
0.270 |
9 |
11 |
|
[DBV]B:201 |
41 |
1 |
919 |
cf |
B |
x,y,z |
1_555 |
52 |
17 |
9230 |
424.2 |
-9.6 |
0.399 |
2 |
0 |
0 |
0.108 |
12 |
|
[DBV]D:201 |
41 |
1 |
926 |
cf |
D |
x,y,z |
1_555 |
43 |
15 |
9641 |
416.0 |
-9.7 |
0.393 |
2 |
0 |
0 |
0.108 |
Average: |
420.1 |
-9.6 |
0.396 |
2 |
0 |
0 |
0.108 |
10 |
13 |
|
B |
47 |
13 |
9230 |
◊ |
D |
-x+1/2,-y,z-1/2 |
2_554 |
44 |
14 |
9641 |
381.8 |
-3.5 |
0.528 |
6 |
3 |
0 |
0.000 |
11 |
14 |
|
B |
38 |
16 |
9230 |
◊ |
C |
x,y,z |
1_555 |
32 |
9 |
6457 |
301.6 |
-1.0 |
0.737 |
4 |
1 |
0 |
0.012 |
12 |
15 |
|
[DBV]B:201 |
38 |
1 |
919 |
◊ |
A |
x,y,z |
1_555 |
32 |
12 |
8060 |
273.6 |
-5.7 |
0.583 |
3 |
0 |
0 |
0.066 |
13 |
16 |
|
[P6G]D:204 |
18 |
1 |
562 |
◊ |
D |
x,y,z |
1_555 |
28 |
13 |
9641 |
251.3 |
1.6 |
0.363 |
0 |
0 |
0 |
0.000 |
14 |
17 |
|
[P6G]B:204 |
18 |
1 |
565 |
◊ |
B |
x,y,z |
1_555 |
28 |
11 |
9230 |
245.4 |
1.3 |
0.348 |
0 |
0 |
0 |
0.000 |
15 |
18 |
|
D |
23 |
7 |
9641 |
x |
D |
x-1,y,z |
1_455 |
28 |
10 |
9641 |
223.8 |
1.9 |
0.866 |
5 |
0 |
0 |
0.000 |
16 |
19 |
|
[DBV]D:201 |
28 |
1 |
926 |
◊ |
B |
x,y,z |
1_555 |
19 |
6 |
9230 |
203.4 |
-2.1 |
0.799 |
1 |
0 |
0 |
0.010 |
17 |
20 |
|
[CYC]D:202 |
17 |
1 |
893 |
◊ |
C |
x,y,z |
1_555 |
25 |
9 |
6457 |
200.5 |
-3.8 |
0.788 |
1 |
0 |
0 |
0.044 |
18 |
21 |
|
[CYC]B:202 |
16 |
1 |
897 |
◊ |
A |
x,y,z |
1_555 |
24 |
9 |
8060 |
191.6 |
-4.4 |
0.735 |
1 |
0 |
0 |
0.045 |
19 |
22 |
|
B |
22 |
7 |
9230 |
◊ |
C |
-x+1,y-1/2,-z+1/2 |
4_645 |
26 |
9 |
6457 |
191.3 |
-2.0 |
0.451 |
1 |
0 |
0 |
0.000 |
20 |
23 |
|
D |
19 |
7 |
9641 |
◊ |
B |
-x,y-1/2,-z+1/2 |
4_545 |
18 |
6 |
9230 |
147.7 |
-1.0 |
0.541 |
0 |
0 |
0 |
0.000 |
21 |
24 |
|
[M1V]C:101 |
17 |
1 |
905 |
◊ |
B |
x,y,z |
1_555 |
19 |
6 |
9230 |
146.7 |
-3.2 |
0.478 |
0 |
0 |
0 |
0.026 |
25 |
|
[M1V]A:101 |
16 |
1 |
906 |
◊ |
D |
x,y,z |
1_555 |
18 |
6 |
9641 |
145.2 |
-3.2 |
0.464 |
0 |
0 |
0 |
0.026 |
Average: |
145.9 |
-3.2 |
0.471 |
0 |
0 |
0 |
0.026 |
22 |
26 |
|
[CYC]B:203 |
17 |
1 |
912 |
◊ |
A |
x,y,z |
1_555 |
18 |
6 |
8060 |
138.6 |
-2.9 |
0.661 |
1 |
0 |
0 |
0.032 |
23 |
27 |
|
[M1V]C:101 |
16 |
1 |
905 |
◊ |
A |
x,y,z |
1_555 |
18 |
6 |
8060 |
136.1 |
-3.4 |
0.619 |
0 |
0 |
0 |
0.082 |
24 |
28 |
|
[CYC]D:203 |
16 |
1 |
911 |
◊ |
C |
x,y,z |
1_555 |
17 |
5 |
6457 |
128.9 |
-2.5 |
0.665 |
1 |
0 |
0 |
0.030 |
25 |
29 |
|
[P6G]D:204 |
13 |
1 |
562 |
f |
C |
x,y,z |
1_555 |
13 |
5 |
6457 |
118.2 |
-1.9 |
0.166 |
0 |
0 |
0 |
0.047 |
26 |
30 |
|
[M1V]A:101 |
15 |
1 |
906 |
◊ |
C |
x,y,z |
1_555 |
13 |
5 |
6457 |
116.8 |
-3.2 |
0.525 |
0 |
0 |
0 |
0.078 |
27 |
31 |
|
A |
12 |
3 |
8060 |
◊ |
B |
-x,y-1/2,-z+1/2 |
4_545 |
13 |
5 |
9230 |
112.2 |
-0.2 |
0.687 |
2 |
0 |
0 |
0.000 |
28 |
32 |
|
[P6G]B:204 |
10 |
1 |
565 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
8060 |
97.9 |
-2.3 |
0.167 |
0 |
0 |
0 |
0.055 |
29 |
33 |
|
A |
12 |
3 |
8060 |
◊ |
D |
-x,y-1/2,-z+1/2 |
4_545 |
13 |
4 |
9641 |
92.6 |
0.3 |
0.639 |
0 |
0 |
0 |
0.000 |
30 |
34 |
|
D |
14 |
9 |
9641 |
◊ |
B |
x,y,z |
1_555 |
16 |
8 |
9230 |
92.5 |
-0.8 |
0.531 |
0 |
0 |
0 |
0.003 |
31 |
35 |
|
[M1V]A:101 |
8 |
1 |
906 |
◊ |
B |
x,y,z |
1_555 |
9 |
3 |
9230 |
90.0 |
-1.5 |
0.538 |
1 |
0 |
0 |
0.020 |
36 |
|
[M1V]C:101 |
8 |
1 |
905 |
◊ |
D |
x,y,z |
1_555 |
9 |
3 |
9641 |
84.2 |
-1.5 |
0.527 |
1 |
0 |
0 |
0.020 |
Average: |
87.1 |
-1.5 |
0.533 |
1 |
0 |
0 |
0.020 |
32 |
37 |
|
[DBV]D:201 |
4 |
1 |
926 |
◊ |
C |
x,y,z |
1_555 |
10 |
2 |
6457 |
85.0 |
-1.3 |
0.559 |
0 |
0 |
0 |
0.013 |
33 |
38 |
|
B |
12 |
2 |
9230 |
◊ |
[P6G]D:204 |
-x+1/2,-y,z-1/2 |
2_554 |
9 |
1 |
562 |
82.7 |
1.6 |
0.510 |
0 |
0 |
0 |
0.000 |
34 |
39 |
|
[CYC]B:202 |
8 |
1 |
897 |
◊ |
C |
-x+1,y-1/2,-z+1/2 |
4_645 |
8 |
4 |
6457 |
75.8 |
-0.5 |
0.792 |
0 |
0 |
0 |
0.000 |
35 |
40 |
|
[DBV]D:201 |
5 |
1 |
926 |
◊ |
A |
x,y,z |
1_555 |
8 |
2 |
8060 |
73.2 |
-1.1 |
0.498 |
1 |
0 |
0 |
0.006 |
36 |
41 |
|
[DBV]D:201 |
9 |
1 |
926 |
◊ |
[DBV]B:201 |
x,y,z |
1_555 |
9 |
1 |
919 |
68.4 |
-0.6 |
0.925 |
0 |
0 |
0 |
0.002 |
37 |
42 |
|
[P6G]B:204 |
7 |
1 |
565 |
◊ |
D |
-x+1/2,-y,z-1/2 |
2_554 |
11 |
2 |
9641 |
65.2 |
1.2 |
0.497 |
0 |
0 |
0 |
0.000 |
38 |
43 |
|
A |
8 |
4 |
8060 |
◊ |
D |
-x+1/2,-y,z-1/2 |
2_554 |
4 |
3 |
9641 |
62.1 |
0.3 |
0.596 |
0 |
0 |
0 |
0.000 |
39 |
44 |
|
B |
4 |
3 |
9230 |
◊ |
C |
-x+1/2,-y,z-1/2 |
2_554 |
8 |
4 |
6457 |
58.6 |
0.6 |
0.647 |
0 |
0 |
0 |
0.000 |
40 |
45 |
|
[CYC]D:203 |
5 |
1 |
911 |
◊ |
D |
x-1,y,z |
1_455 |
10 |
4 |
9641 |
55.8 |
-2.2 |
0.473 |
0 |
0 |
0 |
0.000 |
41 |
46 |
|
C |
4 |
1 |
6457 |
◊ |
D |
x-1,y,z |
1_455 |
9 |
3 |
9641 |
51.5 |
0.2 |
0.732 |
0 |
0 |
0 |
0.000 |
42 |
47 |
|
[DBV]B:201 |
6 |
1 |
919 |
◊ |
D |
x,y,z |
1_555 |
7 |
4 |
9641 |
48.0 |
-2.1 |
0.247 |
0 |
0 |
0 |
0.009 |
43 |
48 |
|
A |
3 |
1 |
8060 |
◊ |
[M1V]C:101 |
-x,y-1/2,-z+1/2 |
4_545 |
4 |
1 |
905 |
39.6 |
0.5 |
0.838 |
1 |
0 |
0 |
0.000 |
44 |
49 |
|
A |
3 |
2 |
8060 |
◊ |
C |
-x,y-1/2,-z+1/2 |
4_545 |
6 |
3 |
6457 |
36.0 |
1.0 |
0.811 |
1 |
1 |
0 |
0.000 |
45 |
50 |
|
[M1V]A:101 |
4 |
1 |
906 |
◊ |
B |
-x,y-1/2,-z+1/2 |
4_545 |
6 |
4 |
9230 |
31.9 |
-0.1 |
0.742 |
0 |
0 |
0 |
0.000 |
46 |
51 |
|
A |
8 |
4 |
8060 |
◊ |
C |
-x+1/2,-y,z-1/2 |
2_554 |
5 |
3 |
6457 |
29.3 |
-0.5 |
0.585 |
0 |
0 |
0 |
0.000 |
47 |
52 |
|
D |
3 |
1 |
9641 |
◊ |
[CYC]D:202 |
x-1,y,z |
1_455 |
3 |
1 |
893 |
28.8 |
0.9 |
0.943 |
1 |
0 |
0 |
0.000 |
48 |
53 |
|
A |
1 |
1 |
8060 |
◊ |
C |
-x+1,y-1/2,-z+1/2 |
4_645 |
3 |
2 |
6457 |
7.6 |
-0.2 |
0.481 |
0 |
0 |
0 |
0.000 |
49 |
54 |
|
[CYC]D:202 |
1 |
1 |
893 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
8060 |
5.9 |
-0.2 |
0.608 |
0 |
0 |
0 |
0.000 |
50 |
55 |
|
[P6G]B:204 |
1 |
1 |
565 |
◊ |
[P6G]D:204 |
-x+1/2,-y,z-1/2 |
2_554 |
1 |
1 |
562 |
5.4 |
0.1 |
0.579 |
0 |
0 |
0 |
0.000 |
51 |
56 |
|
A |
3 |
1 |
8060 |
x |
A |
-x,y-1/2,-z+1/2 |
4_545 |
1 |
1 |
8060 |
4.5 |
0.1 |
0.712 |
0 |
0 |
0 |
0.000 |
|