## |
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 |
121 |
29 |
10330 |
◊ |
A |
x,y,z |
1_555 |
119 |
29 |
9761 |
1127.3 |
0.4 |
0.828 |
23 |
13 |
0 |
0.896 |
2 |
|
C |
121 |
29 |
10519 |
◊ |
C |
-x,y,-z |
3_555 |
121 |
29 |
10519 |
1082.9 |
-0.6 |
0.841 |
22 |
12 |
0 |
0.896 |
Average: |
1105.1 |
-0.1 |
0.835 |
23 |
13 |
0 |
0.896 |
2 |
3 |
|
C |
86 |
21 |
10519 |
◊ |
B |
x,y,z |
1_555 |
78 |
27 |
10330 |
817.9 |
-6.0 |
0.303 |
11 |
4 |
0 |
1.000 |
4 |
|
B |
86 |
22 |
10330 |
◊ |
A |
-x,-y+2,z |
2_575 |
82 |
27 |
9761 |
815.1 |
-6.2 |
0.309 |
13 |
4 |
0 |
1.000 |
5 |
|
C |
74 |
26 |
10519 |
◊ |
A |
-x,y,-z |
3_555 |
83 |
22 |
9761 |
783.5 |
-7.4 |
0.209 |
7 |
3 |
0 |
1.000 |
Average: |
805.5 |
-6.5 |
0.274 |
10 |
4 |
0 |
1.000 |
3 |
6 |
|
A |
91 |
29 |
9761 |
◊ |
B |
x-1/2,-y+5/2,-z+1/2 |
8_475 |
66 |
18 |
10330 |
704.3 |
-3.7 |
0.424 |
6 |
1 |
0 |
0.000 |
4 |
7 |
|
C |
55 |
14 |
10519 |
◊ |
B |
-x+1/2,-y+5/2,z-1/2 |
6_574 |
76 |
22 |
10330 |
583.0 |
-3.6 |
0.453 |
14 |
0 |
0 |
0.025 |
5 |
8 |
|
C |
34 |
8 |
10519 |
◊ |
B |
-x,y,-z |
3_555 |
33 |
8 |
10330 |
289.9 |
-0.1 |
0.674 |
2 |
0 |
0 |
0.033 |
9 |
|
A |
34 |
8 |
9761 |
◊ |
A |
-x,-y+2,z |
2_575 |
33 |
8 |
9761 |
288.3 |
-0.1 |
0.654 |
2 |
0 |
0 |
0.033 |
Average: |
289.1 |
-0.1 |
0.664 |
2 |
0 |
0 |
0.033 |
6 |
10 |
|
[MLI]C:204 |
7 |
1 |
226 |
f |
C |
x,y,z |
1_555 |
24 |
12 |
10519 |
143.5 |
2.9 |
0.192 |
2 |
0 |
0 |
0.000 |
7 |
11 |
|
[MLI]C:206 |
7 |
1 |
225 |
f |
C |
x,y,z |
1_555 |
22 |
10 |
10519 |
135.0 |
2.0 |
0.118 |
0 |
0 |
0 |
0.000 |
8 |
12 |
|
[PEG]A:203 |
7 |
1 |
259 |
◊ |
A |
x,y,z |
1_555 |
25 |
7 |
9761 |
132.7 |
3.7 |
0.425 |
2 |
0 |
0 |
0.000 |
9 |
13 |
|
[PEG]B:201 |
7 |
1 |
253 |
f |
B |
x,y,z |
1_555 |
18 |
5 |
10330 |
102.7 |
0.7 |
0.191 |
1 |
0 |
0 |
0.000 |
10 |
14 |
|
[MLI]C:205 |
7 |
1 |
223 |
◊ |
C |
x,y,z |
1_555 |
18 |
5 |
10519 |
99.5 |
1.5 |
0.687 |
2 |
0 |
0 |
0.000 |
11 |
15 |
|
[MLI]B:202 |
7 |
1 |
224 |
◊ |
B |
x,y,z |
1_555 |
12 |
6 |
10330 |
97.8 |
2.1 |
0.857 |
0 |
0 |
0 |
0.000 |
12 |
16 |
|
[MLI]A:204 |
7 |
1 |
221 |
◊ |
A |
x,y,z |
1_555 |
12 |
7 |
9761 |
90.2 |
1.6 |
0.830 |
0 |
0 |
0 |
0.000 |
13 |
17 |
|
[MLI]C:203 |
6 |
1 |
223 |
◊ |
C |
-x,y,-z |
3_555 |
13 |
8 |
10519 |
77.7 |
1.3 |
0.857 |
0 |
0 |
0 |
0.000 |
14 |
18 |
|
[MLI]B:202 |
7 |
1 |
224 |
◊ |
A |
x,y,z |
1_555 |
13 |
4 |
9761 |
77.2 |
3.2 |
0.948 |
0 |
0 |
0 |
0.000 |
15 |
19 |
|
[MLI]C:202 |
7 |
1 |
220 |
◊ |
C |
x,y,z |
1_555 |
9 |
6 |
10519 |
68.8 |
1.5 |
0.842 |
0 |
0 |
0 |
0.000 |
16 |
20 |
|
[MLI]A:204 |
7 |
1 |
221 |
◊ |
B |
x,y,z |
1_555 |
10 |
4 |
10330 |
68.4 |
2.2 |
0.935 |
1 |
0 |
0 |
0.000 |
17 |
21 |
|
[MLI]C:203 |
7 |
1 |
223 |
f |
[MLI]C:202 |
-x,y,-z |
3_555 |
7 |
1 |
220 |
62.3 |
3.2 |
1.000 |
0 |
0 |
0 |
0.000 |
18 |
22 |
|
[MLI]C:202 |
7 |
1 |
220 |
◊ |
C |
-x,y,-z |
3_555 |
10 |
4 |
10519 |
57.3 |
1.9 |
0.955 |
2 |
0 |
0 |
0.000 |
19 |
23 |
|
[MLI]C:203 |
6 |
1 |
223 |
◊ |
C |
x,y,z |
1_555 |
13 |
4 |
10519 |
51.7 |
2.0 |
0.939 |
0 |
0 |
0 |
0.000 |
20 |
24 |
|
[PEG]B:201 |
2 |
1 |
253 |
◊ |
A |
-x,-y+2,z |
2_575 |
7 |
2 |
9761 |
36.1 |
0.8 |
0.436 |
0 |
0 |
0 |
0.000 |
21 |
25 |
|
[MLI]C:205 |
3 |
1 |
223 |
f |
B |
x,y,z |
1_555 |
8 |
2 |
10330 |
35.4 |
0.6 |
0.724 |
0 |
0 |
0 |
0.000 |
22 |
26 |
|
[CA]C:201 |
1 |
1 |
85 |
x |
C |
x,y,z |
1_555 |
5 |
2 |
10519 |
31.8 |
-5.4 |
0.000 |
0 |
0 |
0 |
1.000 |
27 |
|
[CA]A:202 |
1 |
1 |
85 |
x |
B |
x,y,z |
1_555 |
6 |
2 |
10330 |
30.2 |
-5.4 |
0.000 |
0 |
0 |
0 |
1.000 |
28 |
|
[CA]A:201 |
1 |
1 |
85 |
x |
A |
x,y,z |
1_555 |
6 |
2 |
9761 |
29.9 |
-5.9 |
0.000 |
0 |
0 |
0 |
1.000 |
29 |
|
[CA]A:201 |
1 |
1 |
85 |
x |
B |
x,y,z |
1_555 |
6 |
2 |
10330 |
28.1 |
-3.9 |
0.000 |
0 |
0 |
0 |
1.000 |
30 |
|
[CA]A:202 |
1 |
1 |
85 |
x |
A |
x,y,z |
1_555 |
5 |
2 |
9761 |
26.3 |
-3.7 |
0.000 |
0 |
0 |
0 |
1.000 |
Average: |
29.2 |
-4.9 |
0.000 |
0 |
0 |
0 |
1.000 |
23 |
31 |
|
[PEG]A:203 |
2 |
1 |
259 |
f |
B |
x,y,z |
1_555 |
5 |
3 |
10330 |
26.2 |
-0.3 |
0.216 |
1 |
0 |
0 |
0.033 |
24 |
32 |
|
[MLI]A:204 |
2 |
1 |
221 |
◊ |
[PEG]A:203 |
x,y,z |
1_555 |
5 |
1 |
259 |
26.1 |
1.3 |
0.189 |
0 |
0 |
0 |
0.000 |
25 |
33 |
|
[MLI]B:202 |
2 |
1 |
224 |
f |
[MLI]A:204 |
x,y,z |
1_555 |
3 |
1 |
221 |
24.8 |
0.6 |
1.000 |
0 |
0 |
0 |
0.000 |
26 |
34 |
|
[MLI]C:203 |
3 |
1 |
223 |
f |
[MLI]C:203 |
-x,y,-z |
3_555 |
3 |
1 |
223 |
16.6 |
0.5 |
1.000 |
0 |
0 |
0 |
0.000 |
27 |
35 |
|
[CA]C:201 |
1 |
1 |
85 |
f |
[CA]C:201 |
-x,y,-z |
3_555 |
1 |
1 |
85 |
15.5 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.341 |
28 |
36 |
|
[MLI]C:203 |
1 |
1 |
223 |
f |
[MLI]C:202 |
x,y,z |
1_555 |
2 |
1 |
220 |
14.2 |
0.3 |
1.000 |
0 |
0 |
0 |
0.000 |
29 |
37 |
|
[CA]A:202 |
1 |
1 |
85 |
f |
[CA]A:201 |
x,y,z |
1_555 |
1 |
1 |
85 |
13.5 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.183 |
30 |
38 |
|
[MLI]C:202 |
5 |
1 |
220 |
f |
[MLI]C:202 |
-x,y,-z |
3_555 |
5 |
1 |
220 |
10.6 |
0.3 |
1.000 |
0 |
0 |
0 |
0.000 |
31 |
39 |
|
[PEG]A:203 |
1 |
1 |
259 |
◊ |
[CA]A:202 |
x,y,z |
1_555 |
1 |
1 |
85 |
5.4 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.020 |
32 |
40 |
|
[MLI]C:203 |
2 |
1 |
223 |
f |
[CA]C:201 |
-x,y,-z |
3_555 |
1 |
1 |
85 |
4.5 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.103 |
33 |
41 |
|
[MLI]C:202 |
2 |
1 |
220 |
f |
[CA]C:201 |
x,y,z |
1_555 |
1 |
1 |
85 |
3.4 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.086 |
34 |
42 |
|
[MLI]A:204 |
2 |
1 |
221 |
f |
[CA]A:202 |
x,y,z |
1_555 |
1 |
1 |
85 |
3.0 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.011 |
35 |
43 |
|
[MLI]B:202 |
1 |
1 |
224 |
f |
[CA]A:201 |
x,y,z |
1_555 |
1 |
1 |
85 |
1.9 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.010 |
|