## |
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 |
|
D |
375 |
94 |
19073 |
◊ |
A |
x,y,z |
1_555 |
361 |
89 |
19284 |
3500.6 |
-48.4 |
0.009 |
40 |
5 |
0 |
0.746 |
2 |
|
C |
358 |
89 |
18905 |
◊ |
B |
x,y,z |
1_555 |
354 |
88 |
19726 |
3371.3 |
-54.1 |
0.002 |
39 |
4 |
0 |
0.746 |
Average: |
3436.0 |
-51.2 |
0.006 |
40 |
5 |
0 |
0.746 |
2 |
3 |
|
B |
112 |
29 |
19726 |
◊ |
A |
x,y,z |
1_555 |
109 |
31 |
19284 |
1015.1 |
2.1 |
0.889 |
4 |
5 |
0 |
0.000 |
3 |
4 |
|
D |
61 |
17 |
19073 |
◊ |
B |
-x-1,y-1/2,-z |
2_445 |
54 |
16 |
19726 |
507.5 |
0.9 |
0.823 |
1 |
1 |
0 |
0.000 |
5 |
|
C |
47 |
14 |
18905 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
39 |
11 |
19284 |
384.0 |
0.5 |
0.786 |
1 |
1 |
0 |
0.000 |
Average: |
445.8 |
0.7 |
0.805 |
1 |
1 |
0 |
0.000 |
4 |
6 |
|
D |
50 |
15 |
19073 |
◊ |
C |
x,y,z-1 |
1_554 |
48 |
12 |
18905 |
443.4 |
-1.9 |
0.620 |
4 |
0 |
0 |
0.000 |
5 |
7 |
|
[NDP]A:503 |
33 |
1 |
749 |
f |
A |
x,y,z |
1_555 |
53 |
21 |
19284 |
408.8 |
-4.6 |
0.254 |
5 |
0 |
0 |
0.069 |
6 |
8 |
|
B |
27 |
10 |
19726 |
◊ |
D |
-x-1,y-1/2,-z |
2_445 |
24 |
7 |
19073 |
224.3 |
-0.3 |
0.663 |
1 |
0 |
0 |
0.000 |
9 |
|
A |
16 |
5 |
19284 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
16 |
4 |
18905 |
154.0 |
-0.1 |
0.595 |
1 |
0 |
0 |
0.000 |
Average: |
189.1 |
-0.2 |
0.629 |
1 |
0 |
0 |
0.000 |
7 |
10 |
|
C |
17 |
5 |
18905 |
◊ |
A |
-x-1,y-1/2,-z |
2_445 |
22 |
7 |
19284 |
195.7 |
-1.3 |
0.490 |
0 |
0 |
0 |
0.000 |
8 |
11 |
|
[ICT]D:501 |
13 |
1 |
315 |
f |
D |
x,y,z |
1_555 |
26 |
11 |
19073 |
169.7 |
0.6 |
0.453 |
10 |
0 |
0 |
0.039 |
12 |
|
[ICT]B:501 |
13 |
1 |
314 |
f |
B |
x,y,z |
1_555 |
26 |
11 |
19726 |
165.8 |
1.6 |
0.533 |
11 |
0 |
0 |
0.039 |
Average: |
167.8 |
1.1 |
0.493 |
11 |
0 |
0 |
0.039 |
9 |
13 |
|
[ICT]C:501 |
13 |
1 |
312 |
f |
C |
x,y,z |
1_555 |
25 |
11 |
18905 |
167.3 |
1.9 |
0.500 |
11 |
0 |
0 |
0.031 |
14 |
|
[ICT]A:501 |
13 |
1 |
312 |
f |
A |
x,y,z |
1_555 |
29 |
15 |
19284 |
151.1 |
3.2 |
0.526 |
11 |
0 |
0 |
0.031 |
Average: |
159.2 |
2.6 |
0.513 |
11 |
0 |
0 |
0.031 |
10 |
15 |
|
[NDP]A:503 |
19 |
1 |
749 |
◊ |
D |
x,y,z |
1_555 |
21 |
8 |
19073 |
155.4 |
0.2 |
0.587 |
2 |
0 |
0 |
0.007 |
11 |
16 |
|
C |
22 |
5 |
18905 |
◊ |
D |
-x-1,y-1/2,-z |
2_445 |
18 |
5 |
19073 |
153.1 |
-1.3 |
0.495 |
2 |
0 |
0 |
0.000 |
12 |
17 |
|
D |
22 |
6 |
19073 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
13 |
5 |
18905 |
135.5 |
-1.4 |
0.484 |
0 |
0 |
0 |
0.000 |
13 |
18 |
|
[FMT]B:504 |
3 |
1 |
148 |
f |
B |
x,y,z |
1_555 |
14 |
8 |
19726 |
92.7 |
0.2 |
0.424 |
0 |
0 |
0 |
0.000 |
14 |
19 |
|
[FMT]B:503 |
3 |
1 |
148 |
f |
B |
x,y,z |
1_555 |
17 |
9 |
19726 |
83.0 |
-0.0 |
0.411 |
0 |
0 |
0 |
0.000 |
15 |
20 |
|
[FMT]A:507 |
3 |
1 |
148 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
19284 |
82.5 |
-0.4 |
0.354 |
0 |
0 |
0 |
0.004 |
16 |
21 |
|
[FMT]A:505 |
3 |
1 |
149 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
19284 |
82.3 |
-0.0 |
0.405 |
3 |
0 |
0 |
0.014 |
17 |
22 |
|
[FMT]D:503 |
3 |
1 |
148 |
f |
D |
x,y,z |
1_555 |
10 |
5 |
19073 |
75.8 |
0.7 |
0.748 |
0 |
0 |
0 |
0.000 |
18 |
23 |
|
[ICT]A:501 |
8 |
1 |
312 |
◊ |
D |
x,y,z |
1_555 |
8 |
5 |
19073 |
70.3 |
0.3 |
0.459 |
1 |
0 |
0 |
0.002 |
19 |
24 |
|
[ICT]B:501 |
8 |
1 |
314 |
◊ |
C |
x,y,z |
1_555 |
8 |
5 |
18905 |
70.1 |
0.4 |
0.514 |
1 |
0 |
0 |
0.009 |
25 |
|
[ICT]D:501 |
8 |
1 |
315 |
◊ |
A |
x,y,z |
1_555 |
7 |
4 |
19284 |
69.4 |
-0.4 |
0.347 |
1 |
0 |
0 |
0.009 |
Average: |
69.7 |
-0.0 |
0.430 |
1 |
0 |
0 |
0.009 |
20 |
26 |
|
[FMT]A:504 |
3 |
1 |
149 |
◊ |
A |
x,y,z |
1_555 |
14 |
5 |
19284 |
67.4 |
0.3 |
0.676 |
0 |
0 |
0 |
0.000 |
21 |
27 |
|
[ICT]C:501 |
8 |
1 |
312 |
◊ |
B |
x,y,z |
1_555 |
7 |
4 |
19726 |
66.3 |
0.6 |
0.500 |
1 |
0 |
0 |
0.000 |
22 |
28 |
|
[FMT]A:506 |
3 |
1 |
149 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
19284 |
46.4 |
-0.1 |
0.410 |
0 |
0 |
0 |
0.000 |
23 |
29 |
|
[FMT]A:507 |
3 |
1 |
148 |
f |
[NDP]A:503 |
x,y,z |
1_555 |
3 |
1 |
749 |
38.5 |
0.5 |
0.466 |
0 |
0 |
0 |
0.000 |
24 |
30 |
|
[MG]C:502 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
10 |
4 |
18905 |
38.2 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.083 |
31 |
|
[MG]D:502 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
10 |
4 |
19073 |
37.0 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.083 |
32 |
|
[MG]B:502 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
19726 |
36.5 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.083 |
33 |
|
[MG]A:502 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
19284 |
35.1 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.083 |
Average: |
36.7 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.083 |
25 |
34 |
|
[NDP]A:503 |
4 |
1 |
749 |
f |
[ICT]A:501 |
x,y,z |
1_555 |
5 |
1 |
312 |
33.5 |
0.4 |
0.428 |
0 |
0 |
0 |
0.000 |
26 |
35 |
|
[FMT]A:506 |
3 |
1 |
149 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
19726 |
31.8 |
-0.3 |
0.324 |
1 |
0 |
0 |
0.008 |
27 |
36 |
|
[MG]C:502 |
1 |
1 |
98 |
f |
[ICT]C:501 |
x,y,z |
1_555 |
4 |
1 |
312 |
28.5 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.058 |
37 |
|
[MG]B:502 |
1 |
1 |
98 |
f |
[ICT]B:501 |
x,y,z |
1_555 |
4 |
1 |
314 |
28.3 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.058 |
38 |
|
[MG]D:502 |
1 |
1 |
98 |
f |
[ICT]D:501 |
x,y,z |
1_555 |
5 |
1 |
315 |
27.6 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.058 |
39 |
|
[MG]A:502 |
1 |
1 |
98 |
f |
[ICT]A:501 |
x,y,z |
1_555 |
4 |
1 |
312 |
26.9 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.058 |
Average: |
27.9 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.058 |
28 |
40 |
|
B |
2 |
1 |
19726 |
◊ |
A |
-x-1,y-1/2,-z |
2_445 |
3 |
1 |
19284 |
25.2 |
-0.1 |
0.540 |
0 |
0 |
0 |
0.000 |
29 |
41 |
|
[MG]A:502 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
3 |
2 |
19073 |
23.7 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.043 |
42 |
|
[MG]B:502 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
18905 |
22.6 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.043 |
43 |
|
[MG]C:502 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
19726 |
21.4 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.043 |
44 |
|
[MG]D:502 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
19284 |
20.9 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.043 |
Average: |
22.2 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.043 |
30 |
45 |
|
D |
5 |
3 |
19073 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
3 |
1 |
19726 |
18.2 |
-0.1 |
0.611 |
0 |
0 |
0 |
0.000 |
31 |
46 |
|
[FMT]A:504 |
1 |
1 |
149 |
f |
D |
x,y,z |
1_555 |
1 |
1 |
19073 |
3.3 |
-0.0 |
0.360 |
0 |
0 |
0 |
0.000 |
|