## |
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 |
145 |
36 |
9047 |
◊ |
A |
x,y,z |
1_555 |
144 |
37 |
9085 |
1283.7 |
-4.9 |
0.598 |
23 |
14 |
0 |
0.414 |
2 |
|
D |
144 |
37 |
9009 |
◊ |
C |
x,y,z |
1_555 |
141 |
37 |
8914 |
1279.6 |
-4.8 |
0.568 |
24 |
14 |
0 |
0.414 |
Average: |
1281.6 |
-4.9 |
0.583 |
24 |
14 |
0 |
0.414 |
2 |
3 |
|
C |
119 |
31 |
8914 |
x |
A |
x,y,z |
1_555 |
102 |
25 |
9085 |
998.0 |
2.0 |
0.753 |
15 |
13 |
0 |
0.389 |
4 |
|
A |
125 |
32 |
9085 |
x |
B |
-y+1,x-y,z |
2_655 |
93 |
21 |
9047 |
981.4 |
1.8 |
0.800 |
18 |
20 |
0 |
0.389 |
5 |
|
D |
118 |
30 |
9009 |
x |
D |
-y+1,x-y,z |
2_655 |
99 |
23 |
9009 |
977.1 |
1.7 |
0.781 |
15 |
15 |
0 |
0.389 |
6 |
|
C |
98 |
21 |
8914 |
x |
B |
-y+1,x-y,z |
2_655 |
114 |
31 |
9047 |
966.4 |
2.2 |
0.814 |
13 |
14 |
0 |
0.389 |
Average: |
980.7 |
1.9 |
0.787 |
15 |
16 |
0 |
0.389 |
3 |
7 |
|
D |
57 |
14 |
9009 |
x |
B |
-y+1,x-y,z |
2_655 |
53 |
14 |
9047 |
510.7 |
-1.1 |
0.620 |
10 |
7 |
0 |
0.371 |
8 |
|
D |
56 |
15 |
9009 |
x |
C |
-y+1,x-y,z |
2_655 |
56 |
14 |
8914 |
505.9 |
-0.6 |
0.630 |
9 |
7 |
0 |
0.371 |
9 |
|
C |
56 |
15 |
8914 |
x |
B |
x,y,z |
1_555 |
56 |
14 |
9047 |
497.4 |
-0.4 |
0.650 |
11 |
6 |
0 |
0.371 |
10 |
|
A |
56 |
14 |
9085 |
x |
A |
-y+1,x-y,z |
2_655 |
59 |
15 |
9085 |
479.4 |
-1.8 |
0.541 |
8 |
2 |
0 |
0.371 |
Average: |
498.3 |
-1.0 |
0.610 |
10 |
6 |
0 |
0.371 |
4 |
11 |
|
A |
18 |
3 |
9085 |
◊ |
B |
y-1/3,x-2/3,-z+1/3 |
10_445 |
18 |
7 |
9047 |
161.9 |
-0.2 |
0.569 |
1 |
2 |
0 |
0.000 |
5 |
12 |
|
B |
18 |
8 |
9047 |
◊ |
B |
x-y+2/3,-y+4/3,-z+1/3 |
12_565 |
18 |
8 |
9047 |
160.9 |
-1.6 |
0.429 |
0 |
0 |
0 |
0.000 |
6 |
13 |
|
B |
14 |
4 |
9047 |
◊ |
A |
x-y+2/3,-y+4/3,-z+1/3 |
12_565 |
10 |
3 |
9085 |
100.9 |
-1.2 |
0.411 |
0 |
0 |
0 |
0.000 |
7 |
14 |
|
D |
12 |
2 |
9009 |
◊ |
C |
y,x,-z |
4_555 |
9 |
2 |
8914 |
84.2 |
-1.6 |
0.287 |
1 |
1 |
0 |
0.000 |
8 |
15 |
|
[CL]A:205 |
1 |
1 |
125 |
fx |
[CL]A:205 |
-y+1,x-y,z |
2_655 |
1 |
1 |
125 |
60.1 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.289 |
9 |
16 |
|
D |
6 |
2 |
9009 |
◊ |
D |
y,x,-z |
4_555 |
6 |
2 |
9009 |
56.3 |
-1.8 |
0.153 |
0 |
0 |
0 |
0.000 |
10 |
17 |
|
[FE2]A:201 |
1 |
1 |
137 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
9047 |
50.6 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.395 |
18 |
|
[FE2]D:201 |
1 |
1 |
137 |
f |
C |
x,y,z |
1_555 |
10 |
5 |
8914 |
50.2 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.395 |
19 |
|
[FE2]C:201 |
1 |
1 |
137 |
f |
D |
x,y,z |
1_555 |
8 |
5 |
9009 |
49.0 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.395 |
20 |
|
[FE2]B:201 |
1 |
1 |
137 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
9085 |
48.7 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.395 |
Average: |
49.6 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.395 |
11 |
21 |
|
[FE2]D:201 |
1 |
1 |
137 |
◊ |
D |
x,y,z |
1_555 |
6 |
2 |
9009 |
50.3 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.281 |
22 |
|
[FE2]A:201 |
1 |
1 |
137 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
9085 |
50.0 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.281 |
23 |
|
[FE2]C:201 |
1 |
1 |
137 |
◊ |
C |
x,y,z |
1_555 |
5 |
2 |
8914 |
49.7 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.281 |
24 |
|
[FE2]B:201 |
1 |
1 |
137 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
9047 |
48.7 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.281 |
Average: |
49.7 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.281 |
12 |
25 |
|
[CL]A:205 |
1 |
1 |
125 |
x |
A |
x,y,z |
1_555 |
4 |
3 |
9085 |
46.3 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.397 |
26 |
|
[CL]D:204 |
1 |
1 |
125 |
x |
B |
-y+1,x-y,z |
2_655 |
4 |
3 |
9047 |
38.8 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.397 |
27 |
|
[CL]D:204 |
1 |
1 |
125 |
x |
C |
-y+1,x-y,z |
2_655 |
4 |
3 |
8914 |
38.7 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.397 |
28 |
|
[CL]D:204 |
1 |
1 |
125 |
x |
D |
x,y,z |
1_555 |
4 |
3 |
9009 |
38.3 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.397 |
Average: |
40.5 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.397 |
13 |
29 |
|
C |
3 |
1 |
8914 |
x |
A |
-y+1,x-y,z |
2_655 |
5 |
2 |
9085 |
43.3 |
1.1 |
0.863 |
2 |
2 |
0 |
0.001 |
30 |
|
C |
5 |
3 |
8914 |
x |
D |
-y+1,x-y,z |
2_655 |
3 |
1 |
9009 |
43.1 |
1.1 |
0.862 |
2 |
2 |
0 |
0.001 |
31 |
|
D |
5 |
3 |
9009 |
x |
A |
x,y,z |
1_555 |
2 |
1 |
9085 |
42.4 |
1.1 |
0.875 |
2 |
2 |
0 |
0.001 |
32 |
|
B |
4 |
2 |
9047 |
x |
B |
-y+1,x-y,z |
2_655 |
3 |
1 |
9047 |
42.4 |
1.4 |
0.892 |
2 |
2 |
0 |
0.001 |
Average: |
42.8 |
1.1 |
0.873 |
2 |
2 |
0 |
0.001 |
14 |
33 |
|
A |
3 |
1 |
9085 |
◊ |
C |
-y,x-y,z |
2_555 |
3 |
1 |
8914 |
42.1 |
-0.8 |
0.241 |
0 |
0 |
0 |
0.000 |
15 |
34 |
|
[MG]A:202 |
1 |
1 |
98 |
x |
A |
x,y,z |
1_555 |
7 |
3 |
9085 |
39.8 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.303 |
35 |
|
[MG]B:202 |
1 |
1 |
98 |
x |
C |
x,y,z |
1_555 |
7 |
3 |
8914 |
26.0 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.303 |
36 |
|
[MG]B:202 |
1 |
1 |
98 |
x |
B |
x,y,z |
1_555 |
6 |
3 |
9047 |
26.0 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.303 |
37 |
|
D |
7 |
3 |
9009 |
x |
[MG]B:202 |
-y+1,x-y,z |
2_655 |
1 |
1 |
98 |
25.8 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.303 |
Average: |
29.4 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.303 |
16 |
38 |
|
[MG]D:203 |
1 |
1 |
98 |
x |
D |
x,y,z |
1_555 |
5 |
2 |
9009 |
36.2 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.127 |
39 |
|
[MG]A:204 |
1 |
1 |
98 |
x |
B |
-y+1,x-y,z |
2_655 |
6 |
3 |
9047 |
31.4 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.127 |
40 |
|
[MG]A:204 |
1 |
1 |
98 |
x |
A |
x,y,z |
1_555 |
6 |
3 |
9085 |
30.4 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.127 |
41 |
|
[MG]A:204 |
1 |
1 |
98 |
x |
C |
x,y,z |
1_555 |
6 |
3 |
8914 |
29.5 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.127 |
Average: |
31.9 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.127 |
17 |
42 |
|
[MG]D:202 |
1 |
1 |
98 |
fx |
[MG]D:202 |
-y+1,x-y,z |
2_655 |
1 |
1 |
98 |
36.2 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.211 |
18 |
43 |
|
[MG]D:202 |
1 |
1 |
98 |
x |
D |
x,y,z |
1_555 |
5 |
3 |
9009 |
30.4 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.283 |
44 |
|
[MG]A:203 |
1 |
1 |
98 |
x |
C |
x,y,z |
1_555 |
5 |
3 |
8914 |
21.7 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.283 |
45 |
|
[MG]A:203 |
1 |
1 |
98 |
x |
A |
x,y,z |
1_555 |
5 |
3 |
9085 |
21.4 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.283 |
46 |
|
[MG]A:203 |
1 |
1 |
98 |
x |
B |
-y+1,x-y,z |
2_655 |
5 |
3 |
9047 |
17.2 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.283 |
Average: |
22.7 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.283 |
19 |
47 |
|
A |
4 |
2 |
9085 |
◊ |
[FE2]B:201 |
-y+1,x-y,z |
2_655 |
1 |
1 |
137 |
10.3 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.056 |
48 |
|
[FE2]C:201 |
1 |
1 |
137 |
◊ |
B |
-y+1,x-y,z |
2_655 |
4 |
2 |
9047 |
8.3 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.056 |
49 |
|
D |
4 |
2 |
9009 |
◊ |
[FE2]D:201 |
-y+1,x-y,z |
2_655 |
1 |
1 |
137 |
7.3 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.056 |
50 |
|
[FE2]A:201 |
1 |
1 |
137 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
8914 |
6.2 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.056 |
Average: |
8.0 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.056 |
20 |
51 |
|
C |
2 |
1 |
8914 |
x |
C |
-y,x-y,z |
2_555 |
1 |
1 |
8914 |
9.0 |
0.2 |
0.744 |
0 |
0 |
0 |
0.000 |
21 |
52 |
|
[MG]A:204 |
1 |
1 |
98 |
f |
[MG]A:203 |
x,y,z |
1_555 |
1 |
1 |
98 |
4.8 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.100 |
22 |
53 |
|
D |
1 |
1 |
9009 |
x |
D |
-x+1,-x+y,-z |
5_655 |
1 |
1 |
9009 |
3.1 |
-0.1 |
0.403 |
0 |
0 |
0 |
0.000 |
23 |
54 |
|
[MG]D:203 |
1 |
1 |
98 |
fx |
[MG]D:202 |
x,y,z |
1_555 |
1 |
1 |
98 |
0.1 |
-0.0 |
0.000 |
0 |
0 |
0 |
0.000 |
|