## |
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 |
116 |
29 |
16110 |
◊ |
A |
x,y,z |
1_555 |
126 |
35 |
15722 |
1172.1 |
-12.5 |
0.045 |
10 |
0 |
0 |
0.195 |
2 |
|
D |
85 |
24 |
15385 |
◊ |
C |
x,y,z |
1_555 |
72 |
24 |
15446 |
715.6 |
-8.9 |
0.065 |
6 |
1 |
0 |
0.195 |
Average: |
943.9 |
-10.7 |
0.055 |
8 |
1 |
0 |
0.195 |
2 |
3 |
|
B |
54 |
14 |
16110 |
◊ |
C |
-x+2,y-1/2,-z+1 |
2_746 |
62 |
12 |
15446 |
562.8 |
-4.5 |
0.164 |
6 |
3 |
0 |
0.000 |
4 |
|
A |
63 |
13 |
15722 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
50 |
14 |
15385 |
544.7 |
-4.5 |
0.153 |
5 |
3 |
0 |
0.000 |
Average: |
553.7 |
-4.5 |
0.158 |
6 |
3 |
0 |
0.000 |
3 |
5 |
|
A |
59 |
17 |
15722 |
◊ |
C |
-x+2,y-1/2,-z+2 |
2_747 |
68 |
19 |
15446 |
531.5 |
1.3 |
0.687 |
9 |
6 |
0 |
0.000 |
4 |
6 |
|
[51G]D:600 |
29 |
1 |
683 |
f |
D |
x,y,z |
1_555 |
49 |
15 |
15385 |
411.8 |
4.9 |
0.693 |
8 |
0 |
0 |
0.000 |
7 |
|
[51G]C:600 |
28 |
1 |
679 |
f |
C |
x,y,z |
1_555 |
47 |
16 |
15446 |
393.7 |
4.9 |
0.702 |
8 |
0 |
0 |
0.000 |
Average: |
402.8 |
4.9 |
0.698 |
8 |
0 |
0 |
0.000 |
5 |
8 |
|
[51G]A:600 |
29 |
1 |
675 |
f |
A |
x,y,z |
1_555 |
49 |
17 |
15722 |
409.7 |
3.8 |
0.608 |
10 |
0 |
0 |
0.002 |
9 |
|
[51G]B:600 |
28 |
1 |
675 |
f |
B |
x,y,z |
1_555 |
47 |
16 |
16110 |
383.3 |
4.3 |
0.685 |
8 |
0 |
0 |
0.002 |
Average: |
396.5 |
4.1 |
0.646 |
9 |
0 |
0 |
0.002 |
6 |
10 |
|
[GNP]A:500 |
32 |
1 |
618 |
f |
A |
x,y,z |
1_555 |
59 |
24 |
15722 |
405.8 |
-3.5 |
0.296 |
9 |
0 |
0 |
0.170 |
11 |
|
[GNP]B:500 |
32 |
1 |
624 |
f |
B |
x,y,z |
1_555 |
55 |
23 |
16110 |
401.0 |
-3.7 |
0.342 |
8 |
0 |
0 |
0.170 |
12 |
|
[GNP]D:500 |
31 |
1 |
618 |
f |
D |
x,y,z |
1_555 |
51 |
22 |
15385 |
386.4 |
-3.5 |
0.326 |
8 |
0 |
0 |
0.170 |
Average: |
397.7 |
-3.6 |
0.321 |
8 |
0 |
0 |
0.170 |
7 |
13 |
|
[GNP]C:500 |
31 |
1 |
620 |
f |
C |
x,y,z |
1_555 |
56 |
22 |
15446 |
401.7 |
-2.7 |
0.427 |
11 |
0 |
0 |
0.019 |
8 |
14 |
|
B |
40 |
10 |
16110 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
47 |
13 |
15722 |
394.1 |
-2.0 |
0.327 |
4 |
2 |
0 |
0.000 |
9 |
15 |
|
B |
33 |
11 |
16110 |
◊ |
C |
x-1,y,z-1 |
1_454 |
41 |
11 |
15446 |
351.2 |
1.8 |
0.751 |
4 |
3 |
0 |
0.000 |
10 |
16 |
|
D |
36 |
9 |
15385 |
◊ |
C |
x,y,z-1 |
1_554 |
41 |
16 |
15446 |
309.8 |
2.6 |
0.813 |
2 |
0 |
0 |
0.000 |
11 |
17 |
|
C |
24 |
8 |
15446 |
◊ |
A |
x,y,z |
1_555 |
20 |
6 |
15722 |
201.8 |
-2.3 |
0.234 |
2 |
0 |
0 |
0.000 |
12 |
18 |
|
A |
23 |
9 |
15722 |
◊ |
D |
-x+2,y-1/2,-z+1 |
2_746 |
24 |
8 |
15385 |
179.3 |
0.1 |
0.549 |
2 |
1 |
0 |
0.000 |
19 |
|
B |
26 |
8 |
16110 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
20 |
9 |
15446 |
172.0 |
2.1 |
0.771 |
3 |
2 |
0 |
0.000 |
Average: |
175.7 |
1.1 |
0.660 |
3 |
2 |
0 |
0.000 |
13 |
20 |
|
D |
13 |
7 |
15385 |
◊ |
A |
x,y,z |
1_555 |
17 |
8 |
15722 |
133.3 |
2.5 |
0.890 |
4 |
1 |
0 |
0.000 |
14 |
21 |
|
[GOL]B:804 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
19 |
8 |
16110 |
111.0 |
0.0 |
0.604 |
4 |
0 |
0 |
0.020 |
15 |
22 |
|
[GOL]D:804 |
6 |
1 |
218 |
f |
D |
x,y,z |
1_555 |
17 |
7 |
15385 |
103.9 |
0.2 |
0.627 |
3 |
0 |
0 |
0.004 |
16 |
23 |
|
D |
8 |
2 |
15385 |
x |
D |
-x+2,y-1/2,-z+1 |
2_746 |
9 |
2 |
15385 |
83.3 |
-1.7 |
0.158 |
0 |
0 |
0 |
0.000 |
17 |
24 |
|
[CL]A:802 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
15722 |
69.4 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.110 |
25 |
|
[CL]C:802 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
9 |
4 |
15446 |
69.3 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.110 |
Average: |
69.3 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.110 |
18 |
26 |
|
B |
19 |
5 |
16110 |
f |
[CL]B:801 |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
125 |
56.3 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.079 |
19 |
27 |
|
[CL]B:801 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
15722 |
52.2 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.000 |
20 |
28 |
|
[51G]A:600 |
5 |
1 |
675 |
◊ |
B |
x,y,z |
1_555 |
7 |
2 |
16110 |
51.2 |
-0.4 |
0.377 |
0 |
0 |
0 |
0.005 |
21 |
29 |
|
[MG]C:702 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
10 |
5 |
15446 |
37.2 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.096 |
30 |
|
[MG]D:702 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
10 |
5 |
15385 |
35.0 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.096 |
31 |
|
[MG]B:702 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
16110 |
34.0 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.096 |
32 |
|
[MG]A:702 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
15722 |
32.4 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.096 |
Average: |
34.7 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.096 |
22 |
33 |
|
[MG]B:700 |
1 |
1 |
98 |
f |
[GNP]B:500 |
x,y,z |
1_555 |
4 |
1 |
624 |
35.5 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.116 |
34 |
|
[MG]C:700 |
1 |
1 |
98 |
f |
[GNP]C:500 |
x,y,z |
1_555 |
4 |
1 |
620 |
35.3 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.116 |
35 |
|
[MG]D:700 |
1 |
1 |
98 |
f |
[GNP]D:500 |
x,y,z |
1_555 |
6 |
1 |
618 |
34.7 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.116 |
36 |
|
[MG]A:700 |
1 |
1 |
98 |
f |
[GNP]A:500 |
x,y,z |
1_555 |
5 |
1 |
618 |
34.2 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.116 |
Average: |
34.9 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.116 |
23 |
37 |
|
[MG]C:800 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
6 |
2 |
15446 |
35.3 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.010 |
24 |
38 |
|
[51G]A:600 |
3 |
1 |
675 |
f |
[GNP]A:500 |
x,y,z |
1_555 |
4 |
1 |
618 |
34.9 |
1.3 |
0.660 |
0 |
0 |
0 |
0.000 |
39 |
|
[51G]B:600 |
2 |
1 |
675 |
f |
[GNP]B:500 |
x,y,z |
1_555 |
4 |
1 |
624 |
25.1 |
1.0 |
0.659 |
0 |
0 |
0 |
0.000 |
Average: |
30.0 |
1.2 |
0.659 |
0 |
0 |
0 |
0.000 |
25 |
40 |
|
[MG]D:702 |
1 |
1 |
98 |
f |
[GNP]D:500 |
x,y,z |
1_555 |
6 |
1 |
618 |
34.3 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.092 |
41 |
|
[MG]C:702 |
1 |
1 |
98 |
f |
[GNP]C:500 |
x,y,z |
1_555 |
7 |
1 |
620 |
32.5 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.092 |
42 |
|
[MG]A:702 |
1 |
1 |
98 |
f |
[GNP]A:500 |
x,y,z |
1_555 |
5 |
1 |
618 |
31.9 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.092 |
43 |
|
[MG]B:702 |
1 |
1 |
98 |
f |
[GNP]B:500 |
x,y,z |
1_555 |
6 |
1 |
624 |
31.1 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.092 |
Average: |
32.5 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.092 |
26 |
44 |
|
[MG]C:700 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
8 |
4 |
15446 |
32.5 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.088 |
45 |
|
[MG]D:700 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
8 |
4 |
15385 |
28.9 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.088 |
46 |
|
[MG]A:700 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
15722 |
28.5 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.088 |
47 |
|
[MG]B:700 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
16110 |
28.5 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.088 |
Average: |
29.6 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.088 |
27 |
48 |
|
B |
2 |
1 |
16110 |
◊ |
D |
-x+1,y-1/2,-z |
2_645 |
2 |
2 |
15385 |
27.4 |
-0.4 |
0.281 |
0 |
0 |
0 |
0.000 |
28 |
49 |
|
B |
4 |
2 |
16110 |
◊ |
[CL]C:802 |
-x+2,y-1/2,-z+1 |
2_746 |
1 |
1 |
125 |
22.3 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.000 |
50 |
|
[CL]A:802 |
1 |
1 |
125 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
3 |
2 |
15385 |
13.5 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
17.9 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.000 |
29 |
51 |
|
B |
6 |
4 |
16110 |
◊ |
[MG]C:800 |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
98 |
20.6 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.000 |
30 |
52 |
|
C |
3 |
1 |
15446 |
x |
C |
-x+2,y-1/2,-z+2 |
2_747 |
4 |
1 |
15446 |
15.9 |
0.1 |
0.632 |
0 |
0 |
0 |
0.000 |
31 |
53 |
|
D |
2 |
2 |
15385 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
16110 |
14.2 |
0.3 |
0.479 |
0 |
0 |
0 |
0.000 |
32 |
54 |
|
[MG]A:702 |
1 |
1 |
98 |
f |
[51G]A:600 |
x,y,z |
1_555 |
2 |
1 |
675 |
12.5 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.012 |
55 |
|
[MG]B:702 |
1 |
1 |
98 |
f |
[51G]B:600 |
x,y,z |
1_555 |
1 |
1 |
675 |
10.9 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.012 |
Average: |
11.7 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.012 |
33 |
56 |
|
B |
5 |
1 |
16110 |
◊ |
A |
x,y,z-1 |
1_554 |
2 |
2 |
15722 |
10.9 |
0.1 |
0.622 |
0 |
0 |
0 |
0.000 |
34 |
57 |
|
[MG]A:702 |
1 |
1 |
98 |
f |
[MG]A:700 |
x,y,z |
1_555 |
1 |
1 |
98 |
10.6 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.024 |
35 |
58 |
|
[MG]C:702 |
1 |
1 |
98 |
f |
[MG]C:700 |
x,y,z |
1_555 |
1 |
1 |
98 |
10.3 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.005 |
36 |
59 |
|
[MG]B:702 |
1 |
1 |
98 |
f |
[MG]B:700 |
x,y,z |
1_555 |
1 |
1 |
98 |
9.3 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.021 |
37 |
60 |
|
[MG]D:702 |
1 |
1 |
98 |
f |
[MG]D:700 |
x,y,z |
1_555 |
1 |
1 |
98 |
9.3 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.007 |
38 |
61 |
|
B |
1 |
1 |
16110 |
x |
B |
-x+1,y-1/2,-z |
2_645 |
3 |
1 |
16110 |
5.9 |
0.1 |
0.668 |
0 |
0 |
0 |
0.000 |
39 |
62 |
|
[51G]D:600 |
1 |
1 |
683 |
f |
[GNP]D:500 |
x,y,z |
1_555 |
3 |
1 |
618 |
4.3 |
0.1 |
0.504 |
0 |
0 |
0 |
0.000 |
|