## |
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 |
|
A |
91 |
25 |
13945 |
◊ |
C |
x,y-1,z |
1_545 |
91 |
25 |
13940 |
850.7 |
-18.5 |
0.001 |
6 |
5 |
0 |
0.201 |
2 |
|
B |
92 |
25 |
13713 |
◊ |
D |
x,y-1,z |
1_545 |
88 |
25 |
13956 |
850.5 |
-18.2 |
0.002 |
4 |
5 |
0 |
0.201 |
Average: |
850.6 |
-18.4 |
0.002 |
5 |
5 |
0 |
0.201 |
2 |
3 |
|
B |
61 |
24 |
13713 |
◊ |
D |
-x+2,y-1/2,-z+2 |
2_747 |
64 |
19 |
13956 |
569.6 |
0.5 |
0.711 |
6 |
10 |
0 |
0.000 |
4 |
|
B |
59 |
18 |
13713 |
◊ |
D |
-x+3,y-1/2,-z+2 |
2_847 |
58 |
21 |
13956 |
545.5 |
1.3 |
0.756 |
4 |
11 |
0 |
0.000 |
5 |
|
A |
63 |
18 |
13945 |
◊ |
C |
-x+2,y-1/2,-z+1 |
2_746 |
58 |
22 |
13940 |
544.8 |
1.5 |
0.761 |
5 |
11 |
0 |
0.000 |
6 |
|
A |
60 |
23 |
13945 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
63 |
20 |
13940 |
543.2 |
0.2 |
0.663 |
5 |
7 |
0 |
0.000 |
Average: |
550.8 |
0.9 |
0.723 |
5 |
10 |
0 |
0.000 |
3 |
7 |
|
B |
53 |
18 |
13713 |
◊ |
C |
-x+2,y-1/2,-z+1 |
2_746 |
49 |
16 |
13940 |
475.0 |
4.7 |
0.921 |
4 |
8 |
0 |
0.000 |
4 |
8 |
|
B |
38 |
11 |
13713 |
◊ |
C |
-x+2,y-1/2,-z+2 |
2_747 |
38 |
12 |
13940 |
342.1 |
-0.6 |
0.554 |
3 |
1 |
0 |
0.000 |
5 |
9 |
|
[PRP]D:401 |
22 |
1 |
481 |
f |
D |
x,y,z |
1_555 |
47 |
26 |
13956 |
328.0 |
-12.8 |
0.563 |
18 |
0 |
0 |
0.391 |
10 |
|
[PRP]B:401 |
22 |
1 |
481 |
f |
B |
x,y,z |
1_555 |
48 |
26 |
13713 |
325.0 |
-12.8 |
0.543 |
17 |
0 |
0 |
0.391 |
11 |
|
[PRP]C:401 |
22 |
1 |
483 |
f |
C |
x,y,z |
1_555 |
51 |
26 |
13940 |
324.6 |
-12.9 |
0.519 |
17 |
0 |
0 |
0.391 |
12 |
|
[PRP]A:401 |
22 |
1 |
479 |
f |
A |
x,y,z |
1_555 |
48 |
26 |
13945 |
323.6 |
-13.0 |
0.544 |
21 |
0 |
0 |
0.391 |
Average: |
325.3 |
-12.9 |
0.542 |
18 |
0 |
0 |
0.391 |
6 |
13 |
|
[SAL]A:404 |
10 |
1 |
273 |
◊ |
A |
x,y,z |
1_555 |
23 |
9 |
13945 |
187.5 |
3.3 |
0.395 |
2 |
0 |
0 |
0.000 |
14 |
|
[SAL]B:404 |
10 |
1 |
271 |
◊ |
B |
x,y,z |
1_555 |
24 |
9 |
13713 |
186.5 |
3.0 |
0.392 |
2 |
0 |
0 |
0.000 |
15 |
|
[SAL]C:404 |
10 |
1 |
271 |
◊ |
C |
x,y,z |
1_555 |
25 |
9 |
13940 |
183.6 |
2.8 |
0.363 |
2 |
0 |
0 |
0.000 |
16 |
|
[SAL]D:404 |
10 |
1 |
272 |
◊ |
D |
x,y,z |
1_555 |
24 |
9 |
13956 |
179.1 |
2.0 |
0.287 |
1 |
0 |
0 |
0.000 |
Average: |
184.2 |
2.8 |
0.359 |
2 |
0 |
0 |
0.000 |
7 |
17 |
|
[GOL]B:405 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
19 |
8 |
13713 |
144.1 |
-0.9 |
0.451 |
2 |
0 |
0 |
0.017 |
8 |
18 |
|
[GOL]C:405 |
6 |
1 |
220 |
f |
C |
x,y,z |
1_555 |
23 |
8 |
13940 |
141.9 |
-0.5 |
0.499 |
4 |
0 |
0 |
0.021 |
9 |
19 |
|
[GOL]D:405 |
6 |
1 |
219 |
f |
D |
x,y,z |
1_555 |
23 |
8 |
13956 |
140.1 |
-1.0 |
0.440 |
3 |
0 |
0 |
0.021 |
10 |
20 |
|
A |
15 |
6 |
13945 |
◊ |
D |
x-1,y-1,z-1 |
1_444 |
12 |
6 |
13956 |
126.3 |
0.8 |
0.743 |
1 |
1 |
0 |
0.000 |
21 |
|
A |
14 |
6 |
13945 |
◊ |
D |
x-1,y-1,z |
1_445 |
15 |
6 |
13956 |
119.6 |
1.6 |
0.825 |
1 |
1 |
0 |
0.000 |
Average: |
123.0 |
1.2 |
0.784 |
1 |
1 |
0 |
0.000 |
11 |
22 |
|
[MG]D:403 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
12 |
8 |
13956 |
44.9 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.106 |
23 |
|
[MG]C:403 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
12 |
7 |
13940 |
44.4 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.106 |
24 |
|
[MG]A:403 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
13945 |
44.1 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.106 |
25 |
|
[MG]B:403 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
13713 |
43.5 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.106 |
Average: |
44.2 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.106 |
12 |
26 |
|
[MG]D:402 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
8 |
5 |
13956 |
33.1 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.091 |
27 |
|
[MG]A:402 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
13945 |
33.0 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.091 |
28 |
|
[MG]C:402 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
9 |
5 |
13940 |
32.8 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.091 |
29 |
|
[MG]B:402 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
13713 |
32.6 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.091 |
Average: |
32.9 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.091 |
13 |
30 |
|
[MG]C:402 |
1 |
1 |
98 |
f |
[PRP]C:401 |
x,y,z |
1_555 |
3 |
1 |
483 |
31.9 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.149 |
31 |
|
[MG]B:402 |
1 |
1 |
98 |
f |
[PRP]B:401 |
x,y,z |
1_555 |
3 |
1 |
481 |
31.8 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.149 |
32 |
|
[MG]D:402 |
1 |
1 |
98 |
f |
[PRP]D:401 |
x,y,z |
1_555 |
3 |
1 |
481 |
31.7 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.149 |
33 |
|
[MG]A:402 |
1 |
1 |
98 |
f |
[PRP]A:401 |
x,y,z |
1_555 |
3 |
1 |
479 |
31.4 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.149 |
34 |
|
[MG]B:403 |
1 |
1 |
98 |
f |
[PRP]B:401 |
x,y,z |
1_555 |
7 |
1 |
481 |
23.5 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.149 |
35 |
|
[MG]A:403 |
1 |
1 |
98 |
f |
[PRP]A:401 |
x,y,z |
1_555 |
7 |
1 |
479 |
22.7 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.149 |
36 |
|
[MG]D:403 |
1 |
1 |
98 |
f |
[PRP]D:401 |
x,y,z |
1_555 |
7 |
1 |
481 |
21.7 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.149 |
Average: |
27.8 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.149 |
14 |
37 |
|
C |
4 |
1 |
13940 |
◊ |
D |
x-1,y,z-1 |
1_454 |
6 |
3 |
13956 |
31.0 |
0.5 |
0.767 |
1 |
1 |
0 |
0.000 |
38 |
|
A |
2 |
2 |
13945 |
◊ |
B |
x-1,y,z |
1_455 |
2 |
1 |
13713 |
13.3 |
0.2 |
0.630 |
0 |
0 |
0 |
0.000 |
Average: |
22.1 |
0.4 |
0.698 |
1 |
1 |
0 |
0.000 |
15 |
39 |
|
[MG]C:403 |
1 |
1 |
98 |
f |
[PRP]C:401 |
x,y,z |
1_555 |
6 |
1 |
483 |
22.7 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.029 |
16 |
40 |
|
C |
3 |
1 |
13940 |
◊ |
D |
x-1,y,z |
1_455 |
1 |
1 |
13956 |
13.9 |
-0.4 |
0.218 |
0 |
0 |
0 |
0.000 |
41 |
|
A |
2 |
1 |
13945 |
◊ |
B |
x-1,y,z-1 |
1_454 |
1 |
1 |
13713 |
4.8 |
-0.2 |
0.361 |
0 |
0 |
0 |
0.000 |
Average: |
9.4 |
-0.3 |
0.289 |
0 |
0 |
0 |
0.000 |
17 |
42 |
|
[MG]A:403 |
1 |
1 |
98 |
f |
[MG]A:402 |
x,y,z |
1_555 |
1 |
1 |
98 |
13.7 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.025 |
18 |
43 |
|
[MG]B:403 |
1 |
1 |
98 |
f |
[MG]B:402 |
x,y,z |
1_555 |
1 |
1 |
98 |
13.5 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.025 |
19 |
44 |
|
[MG]D:403 |
1 |
1 |
98 |
f |
[MG]D:402 |
x,y,z |
1_555 |
1 |
1 |
98 |
13.4 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.025 |
20 |
45 |
|
[MG]C:403 |
1 |
1 |
98 |
f |
[MG]C:402 |
x,y,z |
1_555 |
1 |
1 |
98 |
13.3 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.024 |
21 |
46 |
|
[SAL]A:404 |
1 |
1 |
273 |
f |
D |
x-1,y-1,z-1 |
1_444 |
1 |
1 |
13956 |
11.3 |
0.6 |
0.665 |
0 |
0 |
0 |
0.000 |
47 |
|
A |
1 |
1 |
13945 |
f |
[SAL]D:404 |
x-1,y-1,z |
1_445 |
1 |
1 |
272 |
8.7 |
0.4 |
0.415 |
0 |
0 |
0 |
0.000 |
Average: |
10.0 |
0.5 |
0.540 |
0 |
0 |
0 |
0.000 |
22 |
48 |
|
B |
1 |
1 |
13713 |
◊ |
D |
x-1,y-1,z |
1_445 |
1 |
1 |
13956 |
10.6 |
0.4 |
0.876 |
0 |
0 |
0 |
0.000 |
23 |
49 |
|
[GOL]D:405 |
1 |
1 |
219 |
f |
[PRP]D:401 |
x,y,z |
1_555 |
1 |
1 |
481 |
1.1 |
-0.1 |
0.500 |
0 |
0 |
0 |
0.000 |
24 |
50 |
|
[GOL]B:405 |
1 |
1 |
218 |
f |
[PRP]B:401 |
x,y,z |
1_555 |
1 |
1 |
481 |
1.0 |
-0.1 |
0.522 |
0 |
0 |
0 |
0.000 |
25 |
51 |
|
[GOL]C:405 |
1 |
1 |
220 |
f |
[PRP]C:401 |
x,y,z |
1_555 |
1 |
1 |
483 |
0.3 |
-0.0 |
0.522 |
0 |
0 |
0 |
0.000 |
|