## |
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 |
|
E |
137 |
34 |
12466 |
◊ |
A |
x,y,z |
1_555 |
169 |
46 |
17787 |
1495.0 |
-17.4 |
0.173 |
19 |
2 |
0 |
0.475 |
2 |
2 |
|
B |
142 |
37 |
17875 |
◊ |
A |
x,y,z |
1_555 |
149 |
34 |
17787 |
1361.1 |
-13.4 |
0.125 |
14 |
11 |
0 |
0.289 |
3 |
|
D |
144 |
39 |
17734 |
◊ |
C |
x,y,z |
1_555 |
144 |
37 |
17915 |
1353.4 |
-11.3 |
0.243 |
19 |
12 |
0 |
0.289 |
Average: |
1357.3 |
-12.3 |
0.184 |
17 |
12 |
0 |
0.289 |
3 |
4 |
|
B |
104 |
28 |
17875 |
◊ |
C |
x,y,z |
1_555 |
120 |
31 |
17915 |
958.0 |
-9.2 |
0.220 |
12 |
2 |
0 |
0.228 |
4 |
5 |
|
E |
76 |
16 |
12466 |
◊ |
C |
x,y,z |
1_555 |
84 |
25 |
17915 |
786.9 |
-10.0 |
0.190 |
9 |
6 |
0 |
0.379 |
5 |
6 |
|
D |
88 |
26 |
17734 |
◊ |
F |
-x,y-1/2,-z+1/2 |
3_545 |
86 |
23 |
17213 |
785.8 |
3.7 |
0.767 |
11 |
4 |
0 |
0.000 |
6 |
7 |
|
F |
77 |
22 |
17213 |
◊ |
A |
x,y,z |
1_555 |
90 |
23 |
17787 |
760.6 |
-0.2 |
0.658 |
9 |
7 |
0 |
0.000 |
7 |
8 |
|
E |
55 |
15 |
12466 |
◊ |
D |
x,y,z |
1_555 |
77 |
21 |
17734 |
663.8 |
-3.9 |
0.512 |
6 |
4 |
0 |
0.074 |
8 |
9 |
|
E |
62 |
15 |
12466 |
◊ |
B |
x,y,z |
1_555 |
81 |
21 |
17875 |
652.3 |
-1.8 |
0.630 |
6 |
5 |
0 |
0.052 |
9 |
10 |
|
C |
62 |
19 |
17915 |
◊ |
E |
x-1/2,-y+1/2,-z |
4_455 |
48 |
12 |
12466 |
500.9 |
-1.0 |
0.678 |
6 |
5 |
0 |
0.000 |
10 |
11 |
|
F |
48 |
13 |
17213 |
◊ |
B |
x,y,z |
1_555 |
54 |
13 |
17875 |
442.9 |
-0.1 |
0.632 |
3 |
1 |
0 |
0.000 |
11 |
12 |
|
[GTP]C:501 |
32 |
1 |
631 |
f |
C |
x,y,z |
1_555 |
68 |
29 |
17915 |
420.2 |
-2.4 |
0.588 |
20 |
0 |
0 |
0.285 |
13 |
|
[GTP]A:501 |
32 |
1 |
626 |
f |
A |
x,y,z |
1_555 |
63 |
29 |
17787 |
417.9 |
-3.0 |
0.522 |
19 |
0 |
0 |
0.285 |
Average: |
419.0 |
-2.7 |
0.555 |
20 |
0 |
0 |
0.285 |
12 |
14 |
|
[ACP]F:401 |
31 |
1 |
618 |
f |
F |
x,y,z |
1_555 |
55 |
21 |
17213 |
409.3 |
1.3 |
0.719 |
10 |
0 |
0 |
0.025 |
13 |
15 |
|
[GDP]B:501 |
28 |
1 |
561 |
f |
B |
x,y,z |
1_555 |
63 |
27 |
17875 |
406.7 |
-6.9 |
0.548 |
10 |
0 |
0 |
0.175 |
16 |
|
[GDP]D:502 |
28 |
1 |
564 |
f |
D |
x,y,z |
1_555 |
61 |
28 |
17734 |
406.2 |
-7.3 |
0.525 |
9 |
0 |
0 |
0.175 |
Average: |
406.4 |
-7.1 |
0.537 |
10 |
0 |
0 |
0.175 |
14 |
17 |
|
C |
33 |
10 |
17915 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
39 |
12 |
17787 |
315.8 |
-0.2 |
0.593 |
2 |
0 |
0 |
0.000 |
15 |
18 |
|
C |
39 |
9 |
17915 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
38 |
11 |
17787 |
312.1 |
0.1 |
0.703 |
2 |
3 |
0 |
0.000 |
16 |
19 |
|
[WZD]D:504 |
16 |
1 |
407 |
f |
D |
x,y,z |
1_555 |
38 |
21 |
17734 |
276.0 |
-4.5 |
0.433 |
1 |
0 |
0 |
0.067 |
17 |
20 |
|
[WZD]B:505 |
16 |
1 |
401 |
f |
B |
x,y,z |
1_555 |
34 |
19 |
17875 |
268.8 |
-4.8 |
0.336 |
0 |
0 |
0 |
0.074 |
18 |
21 |
|
B |
28 |
6 |
17875 |
◊ |
D |
x-1/2,-y+1/2,-z |
4_455 |
37 |
10 |
17734 |
262.4 |
-1.2 |
0.473 |
2 |
5 |
0 |
0.000 |
19 |
22 |
|
C |
34 |
13 |
17915 |
◊ |
E |
-x+1/2,-y+1,z-1/2 |
2_564 |
25 |
6 |
12466 |
262.2 |
-1.7 |
0.498 |
2 |
0 |
0 |
0.000 |
20 |
23 |
|
D |
22 |
8 |
17734 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
29 |
9 |
17787 |
242.8 |
0.2 |
0.611 |
2 |
2 |
0 |
0.000 |
21 |
24 |
|
C |
29 |
7 |
17915 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
33 |
10 |
17875 |
207.0 |
-0.5 |
0.579 |
2 |
1 |
0 |
0.000 |
22 |
25 |
|
B |
26 |
7 |
17875 |
◊ |
E |
x-1/2,-y+1/2,-z |
4_455 |
23 |
10 |
12466 |
205.2 |
1.2 |
0.782 |
1 |
4 |
0 |
0.000 |
23 |
26 |
|
[MES]B:504 |
12 |
1 |
333 |
◊ |
B |
x,y,z |
1_555 |
30 |
12 |
17875 |
194.3 |
7.0 |
0.358 |
0 |
0 |
0 |
0.000 |
24 |
27 |
|
D |
16 |
7 |
17734 |
◊ |
E |
x-1/2,-y+1/2,-z |
4_455 |
16 |
8 |
12466 |
152.8 |
2.5 |
0.835 |
3 |
3 |
0 |
0.000 |
25 |
28 |
|
C |
9 |
4 |
17915 |
x |
C |
x-1/2,-y+1/2,-z |
4_455 |
19 |
8 |
17915 |
92.0 |
1.1 |
0.783 |
2 |
1 |
0 |
0.000 |
26 |
29 |
|
A |
10 |
4 |
17787 |
◊ |
F |
-x+1/2,-y+1,z-1/2 |
2_564 |
7 |
2 |
17213 |
73.1 |
0.3 |
0.491 |
0 |
0 |
0 |
0.000 |
27 |
30 |
|
[MG]B:502 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
17875 |
51.7 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.080 |
31 |
|
[MG]D:503 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
8 |
4 |
17734 |
48.2 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.080 |
Average: |
50.0 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.080 |
28 |
32 |
|
B |
5 |
3 |
17875 |
◊ |
E |
-x+1/2,-y+1,z-1/2 |
2_564 |
4 |
2 |
12466 |
49.9 |
-0.7 |
0.352 |
0 |
0 |
0 |
0.000 |
29 |
33 |
|
[CA]A:504 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
17787 |
47.4 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.141 |
30 |
34 |
|
[MG]F:402 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
8 |
5 |
17213 |
41.6 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.037 |
31 |
35 |
|
[MG]A:502 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
17787 |
41.4 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.102 |
36 |
|
[MG]D:501 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
10 |
5 |
17915 |
40.3 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.102 |
Average: |
40.9 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.102 |
32 |
37 |
|
[MES]B:504 |
4 |
1 |
333 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
17787 |
37.8 |
0.2 |
0.087 |
0 |
0 |
0 |
0.000 |
33 |
38 |
|
[GTP]A:501 |
6 |
1 |
626 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
17875 |
35.9 |
0.4 |
0.712 |
1 |
0 |
0 |
0.001 |
39 |
|
[GTP]C:501 |
6 |
1 |
631 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
17734 |
35.4 |
0.4 |
0.700 |
1 |
0 |
0 |
0.001 |
Average: |
35.6 |
0.4 |
0.706 |
1 |
0 |
0 |
0.001 |
34 |
40 |
|
[CA]B:503 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
17875 |
32.9 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.000 |
35 |
41 |
|
[ACP]F:401 |
4 |
1 |
618 |
f |
[MG]F:402 |
x,y,z |
1_555 |
1 |
1 |
98 |
32.7 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.038 |
36 |
42 |
|
C |
8 |
4 |
17915 |
f |
[CA]B:503 |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
85 |
32.3 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.142 |
37 |
43 |
|
[MG]D:501 |
1 |
1 |
98 |
f |
[GTP]C:501 |
x,y,z |
1_555 |
4 |
1 |
631 |
30.0 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.094 |
44 |
|
[MG]A:502 |
1 |
1 |
98 |
f |
[GTP]A:501 |
x,y,z |
1_555 |
4 |
1 |
626 |
27.7 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.094 |
Average: |
28.9 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.094 |
38 |
45 |
|
[GDP]D:502 |
4 |
1 |
564 |
f |
[MG]D:503 |
x,y,z |
1_555 |
1 |
1 |
98 |
26.9 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.057 |
46 |
|
[GDP]B:501 |
4 |
1 |
561 |
f |
[MG]B:502 |
x,y,z |
1_555 |
1 |
1 |
98 |
19.7 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.057 |
Average: |
23.3 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.057 |
39 |
47 |
|
B |
1 |
1 |
17875 |
◊ |
F |
-x+1/2,-y+1,z-1/2 |
2_564 |
3 |
1 |
17213 |
24.0 |
-0.7 |
0.142 |
0 |
0 |
0 |
0.000 |
40 |
48 |
|
[MG]D:501 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
5 |
2 |
17734 |
23.9 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.027 |
49 |
|
[MG]A:502 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
17875 |
13.7 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.027 |
Average: |
18.8 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.027 |
41 |
50 |
|
[MG]B:502 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
17915 |
14.3 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.018 |
42 |
51 |
|
[CA]A:504 |
1 |
1 |
85 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
12466 |
8.0 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.020 |
43 |
52 |
|
[MES]B:504 |
2 |
1 |
333 |
f |
E |
x,y,z |
1_555 |
1 |
1 |
12466 |
3.1 |
0.1 |
0.166 |
0 |
0 |
0 |
0.000 |
|