## |
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 |
68 |
18 |
11676 |
◊ |
D |
x,y,z |
1_555 |
69 |
18 |
11447 |
618.0 |
1.9 |
0.811 |
16 |
17 |
0 |
0.471 |
2 |
|
H |
65 |
17 |
10913 |
◊ |
G |
x,y,z |
1_555 |
64 |
18 |
11014 |
604.8 |
2.9 |
0.867 |
16 |
17 |
0 |
0.471 |
3 |
|
F |
66 |
17 |
11105 |
◊ |
C |
x,y,z |
1_555 |
63 |
16 |
11627 |
596.9 |
2.3 |
0.852 |
16 |
17 |
0 |
0.471 |
4 |
|
B |
63 |
17 |
11644 |
◊ |
A |
x,y,z |
1_555 |
66 |
17 |
11159 |
596.9 |
2.7 |
0.856 |
16 |
16 |
0 |
0.471 |
Average: |
604.2 |
2.5 |
0.846 |
16 |
17 |
0 |
0.471 |
2 |
5 |
|
A |
62 |
19 |
11159 |
◊ |
C |
-x+1/2,-y,z-1/2 |
2_554 |
64 |
21 |
11627 |
596.0 |
-1.8 |
0.533 |
10 |
4 |
0 |
0.000 |
3 |
6 |
|
F |
62 |
19 |
11105 |
◊ |
A |
x,y,z |
1_555 |
60 |
19 |
11159 |
559.6 |
-0.5 |
0.680 |
12 |
16 |
0 |
0.300 |
7 |
|
H |
62 |
20 |
10913 |
◊ |
E |
x,y,z |
1_555 |
61 |
19 |
11676 |
557.4 |
-0.3 |
0.685 |
12 |
16 |
0 |
0.300 |
8 |
|
C |
60 |
20 |
11627 |
◊ |
B |
x,y,z |
1_555 |
62 |
19 |
11644 |
557.0 |
-0.2 |
0.676 |
12 |
16 |
0 |
0.300 |
9 |
|
G |
62 |
19 |
11014 |
◊ |
D |
x,y,z |
1_555 |
60 |
19 |
11447 |
555.3 |
-0.2 |
0.665 |
12 |
16 |
0 |
0.300 |
Average: |
557.3 |
-0.3 |
0.676 |
12 |
16 |
0 |
0.300 |
4 |
10 |
|
B |
50 |
17 |
11644 |
◊ |
E |
x,y-1,z |
1_545 |
42 |
10 |
11676 |
465.5 |
-1.4 |
0.500 |
7 |
6 |
0 |
0.000 |
5 |
11 |
|
D |
47 |
14 |
11447 |
◊ |
A |
x,y,z |
1_555 |
52 |
18 |
11159 |
418.7 |
-2.3 |
0.454 |
4 |
3 |
0 |
0.000 |
6 |
12 |
|
B |
24 |
8 |
11644 |
◊ |
D |
-x+1,y-1/2,-z+1/2 |
3_645 |
35 |
10 |
11447 |
274.2 |
-1.1 |
0.506 |
2 |
0 |
0 |
0.000 |
7 |
13 |
|
C |
30 |
6 |
11627 |
◊ |
E |
-x+1,y-1/2,-z+1/2 |
3_645 |
35 |
11 |
11676 |
272.0 |
-1.6 |
0.480 |
4 |
1 |
0 |
0.000 |
8 |
14 |
|
F |
30 |
9 |
11105 |
◊ |
B |
x,y,z |
1_555 |
32 |
9 |
11644 |
241.9 |
0.1 |
0.670 |
2 |
0 |
0 |
0.033 |
15 |
|
G |
30 |
9 |
11014 |
◊ |
E |
x,y,z |
1_555 |
30 |
9 |
11676 |
241.8 |
0.3 |
0.694 |
2 |
0 |
0 |
0.033 |
16 |
|
C |
31 |
9 |
11627 |
◊ |
A |
x,y,z |
1_555 |
31 |
10 |
11159 |
240.8 |
-0.1 |
0.656 |
2 |
0 |
0 |
0.033 |
17 |
|
H |
31 |
9 |
10913 |
◊ |
D |
x,y,z |
1_555 |
29 |
9 |
11447 |
238.0 |
0.1 |
0.660 |
2 |
0 |
0 |
0.033 |
Average: |
240.6 |
0.1 |
0.670 |
2 |
0 |
0 |
0.033 |
9 |
18 |
|
F |
26 |
9 |
11105 |
◊ |
E |
x,y-1,z |
1_545 |
29 |
5 |
11676 |
230.7 |
-0.1 |
0.652 |
2 |
0 |
0 |
0.000 |
10 |
19 |
|
B |
30 |
10 |
11644 |
◊ |
E |
-x+1,y-1/2,-z+1/2 |
3_645 |
31 |
11 |
11676 |
228.3 |
-2.5 |
0.356 |
1 |
1 |
0 |
0.000 |
11 |
20 |
|
G |
16 |
6 |
11014 |
◊ |
D |
x-1/2,-y+1/2,-z |
4_455 |
16 |
8 |
11447 |
144.9 |
-0.3 |
0.567 |
0 |
0 |
0 |
0.000 |
12 |
21 |
|
[IPA]D:303 |
4 |
1 |
198 |
f |
D |
x,y,z |
1_555 |
21 |
11 |
11447 |
141.6 |
3.0 |
0.265 |
0 |
0 |
0 |
0.000 |
13 |
22 |
|
[IPA]C:302 |
4 |
1 |
199 |
f |
C |
x,y,z |
1_555 |
23 |
12 |
11627 |
139.6 |
4.2 |
0.339 |
0 |
0 |
0 |
0.000 |
14 |
23 |
|
[IPA]B:303 |
4 |
1 |
198 |
f |
B |
x,y,z |
1_555 |
19 |
9 |
11644 |
126.6 |
2.7 |
0.259 |
0 |
0 |
0 |
0.000 |
15 |
24 |
|
[IPA]A:303 |
4 |
1 |
198 |
f |
A |
x,y,z |
1_555 |
19 |
9 |
11159 |
126.3 |
2.8 |
0.254 |
0 |
0 |
0 |
0.000 |
16 |
25 |
|
D |
15 |
4 |
11447 |
◊ |
C |
-x+1/2,-y,z-1/2 |
2_554 |
15 |
3 |
11627 |
126.0 |
-1.4 |
0.374 |
0 |
0 |
0 |
0.000 |
17 |
26 |
|
[IPA]G:302 |
4 |
1 |
198 |
f |
G |
x,y,z |
1_555 |
18 |
9 |
11014 |
123.3 |
2.9 |
0.273 |
0 |
0 |
0 |
0.000 |
18 |
27 |
|
[IPA]E:302 |
4 |
1 |
199 |
◊ |
E |
x,y,z |
1_555 |
17 |
9 |
11676 |
118.5 |
2.4 |
0.268 |
0 |
0 |
0 |
0.000 |
19 |
28 |
|
[IPA]F:302 |
4 |
1 |
198 |
f |
F |
x,y,z |
1_555 |
17 |
9 |
11105 |
117.5 |
2.2 |
0.247 |
0 |
0 |
0 |
0.000 |
20 |
29 |
|
[IPA]F:303 |
4 |
1 |
198 |
f |
F |
x,y,z |
1_555 |
20 |
9 |
11105 |
110.8 |
1.9 |
0.148 |
0 |
0 |
0 |
0.000 |
21 |
30 |
|
[IPA]C:304 |
4 |
1 |
199 |
f |
C |
x,y,z |
1_555 |
20 |
9 |
11627 |
110.4 |
3.4 |
0.447 |
0 |
0 |
0 |
0.000 |
22 |
31 |
|
[IPA]D:305 |
4 |
1 |
199 |
f |
D |
x,y,z |
1_555 |
19 |
8 |
11447 |
108.9 |
3.1 |
0.237 |
0 |
0 |
0 |
0.000 |
23 |
32 |
|
[IPA]B:304 |
4 |
1 |
198 |
f |
B |
x,y,z |
1_555 |
15 |
7 |
11644 |
96.3 |
3.2 |
0.244 |
1 |
0 |
0 |
0.000 |
24 |
33 |
|
[IPA]D:304 |
4 |
1 |
198 |
◊ |
A |
x,y,z |
1_555 |
15 |
7 |
11159 |
91.5 |
2.6 |
0.240 |
0 |
0 |
0 |
0.000 |
25 |
34 |
|
[IPA]C:303 |
4 |
1 |
199 |
f |
C |
x,y,z |
1_555 |
17 |
6 |
11627 |
87.5 |
3.0 |
0.287 |
1 |
0 |
0 |
0.000 |
26 |
35 |
|
[IPA]A:304 |
4 |
1 |
197 |
◊ |
A |
x,y,z |
1_555 |
11 |
4 |
11159 |
82.8 |
2.6 |
0.253 |
0 |
0 |
0 |
0.000 |
27 |
36 |
|
F |
8 |
4 |
11105 |
◊ |
G |
-x,y-1/2,-z+1/2 |
3_545 |
8 |
3 |
11014 |
74.8 |
-1.5 |
0.177 |
0 |
0 |
0 |
0.000 |
28 |
37 |
|
D |
9 |
4 |
11447 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
8 |
3 |
11644 |
67.1 |
1.0 |
0.773 |
0 |
0 |
0 |
0.000 |
29 |
38 |
|
F |
7 |
3 |
11105 |
◊ |
H |
x-1/2,-y+1/2,-z |
4_455 |
9 |
5 |
10913 |
66.4 |
1.2 |
0.790 |
0 |
0 |
0 |
0.000 |
30 |
39 |
|
[IPA]A:302 |
3 |
1 |
198 |
◊ |
F |
x,y,z |
1_555 |
12 |
3 |
11105 |
65.4 |
1.4 |
0.185 |
0 |
0 |
0 |
0.000 |
31 |
40 |
|
[IPA]D:302 |
4 |
1 |
199 |
f |
D |
x,y,z |
1_555 |
13 |
4 |
11447 |
63.8 |
1.3 |
0.197 |
0 |
0 |
0 |
0.000 |
32 |
41 |
|
[IPA]B:302 |
3 |
1 |
199 |
◊ |
C |
x,y,z |
1_555 |
12 |
4 |
11627 |
61.4 |
1.2 |
0.188 |
0 |
0 |
0 |
0.000 |
33 |
42 |
|
[IPA]A:304 |
4 |
1 |
197 |
f |
D |
x,y,z |
1_555 |
9 |
4 |
11447 |
61.0 |
2.6 |
0.302 |
0 |
0 |
0 |
0.000 |
34 |
43 |
|
[IPA]D:302 |
2 |
1 |
199 |
◊ |
G |
x,y,z |
1_555 |
12 |
4 |
11014 |
60.3 |
1.6 |
0.399 |
0 |
0 |
0 |
0.000 |
35 |
44 |
|
[IPA]H:302 |
4 |
1 |
198 |
◊ |
E |
x,y,z |
1_555 |
13 |
4 |
11676 |
58.9 |
1.4 |
0.205 |
0 |
0 |
0 |
0.000 |
36 |
45 |
|
[IPA]H:302 |
4 |
1 |
198 |
f |
H |
x,y,z |
1_555 |
11 |
3 |
10913 |
58.4 |
0.7 |
0.547 |
0 |
0 |
0 |
0.000 |
37 |
46 |
|
[IPA]B:302 |
4 |
1 |
199 |
f |
B |
x,y,z |
1_555 |
11 |
3 |
11644 |
56.8 |
0.7 |
0.550 |
0 |
0 |
0 |
0.000 |
38 |
47 |
|
[IPA]A:302 |
4 |
1 |
198 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
11159 |
56.0 |
0.6 |
0.600 |
0 |
0 |
0 |
0.000 |
39 |
48 |
|
C |
5 |
2 |
11627 |
f |
[IPA]E:302 |
-x+1,y-1/2,-z+1/2 |
3_645 |
3 |
1 |
199 |
38.6 |
0.8 |
0.000 |
0 |
0 |
0 |
0.000 |
40 |
49 |
|
[IPA]D:304 |
2 |
1 |
198 |
f |
D |
x,y,z |
1_555 |
7 |
3 |
11447 |
36.5 |
1.4 |
0.593 |
0 |
0 |
0 |
0.000 |
41 |
50 |
|
[CA]H:301 |
1 |
1 |
85 |
f |
H |
x,y,z |
1_555 |
4 |
3 |
10913 |
34.3 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.974 |
51 |
|
[CA]D:301 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
4 |
3 |
11447 |
33.9 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.974 |
52 |
|
[CA]E:301 |
1 |
1 |
85 |
f |
E |
x,y,z |
1_555 |
4 |
3 |
11676 |
33.9 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.974 |
53 |
|
[CA]A:301 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
4 |
3 |
11159 |
33.8 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.974 |
54 |
|
[CA]G:301 |
1 |
1 |
85 |
f |
G |
x,y,z |
1_555 |
4 |
3 |
11014 |
33.7 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.974 |
55 |
|
[CA]B:301 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
4 |
3 |
11644 |
33.7 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.974 |
56 |
|
[CA]C:301 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
5 |
3 |
11627 |
33.4 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.974 |
57 |
|
[CA]F:301 |
1 |
1 |
85 |
f |
F |
x,y,z |
1_555 |
4 |
3 |
11105 |
33.3 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.974 |
Average: |
33.7 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.974 |
42 |
58 |
|
[CA]G:301 |
1 |
1 |
85 |
◊ |
H |
x,y,z |
1_555 |
8 |
4 |
10913 |
27.2 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.524 |
59 |
|
[CA]B:301 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
8 |
4 |
11159 |
27.0 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.524 |
60 |
|
[CA]D:301 |
1 |
1 |
85 |
◊ |
E |
x,y,z |
1_555 |
8 |
4 |
11676 |
27.0 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.524 |
61 |
|
[CA]E:301 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
8 |
4 |
11447 |
26.8 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.524 |
62 |
|
[CA]A:301 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
11644 |
26.8 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.524 |
63 |
|
[CA]H:301 |
1 |
1 |
85 |
◊ |
G |
x,y,z |
1_555 |
8 |
4 |
11014 |
26.6 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.524 |
64 |
|
[CA]F:301 |
1 |
1 |
85 |
◊ |
C |
x,y,z |
1_555 |
8 |
4 |
11627 |
26.4 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.524 |
65 |
|
[CA]C:301 |
1 |
1 |
85 |
◊ |
F |
x,y,z |
1_555 |
8 |
4 |
11105 |
26.3 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.524 |
Average: |
26.8 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.524 |
43 |
66 |
|
[IPA]D:304 |
1 |
1 |
198 |
f |
[IPA]A:304 |
x,y,z |
1_555 |
2 |
1 |
197 |
20.4 |
1.3 |
0.707 |
0 |
0 |
0 |
0.000 |
44 |
67 |
|
[CA]F:301 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
11159 |
4.8 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.047 |
68 |
|
[CA]B:301 |
1 |
1 |
85 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
11627 |
4.6 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.047 |
69 |
|
[CA]G:301 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
11447 |
4.6 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.047 |
70 |
|
[CA]E:301 |
1 |
1 |
85 |
◊ |
H |
x,y,z |
1_555 |
2 |
1 |
10913 |
4.4 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.047 |
71 |
|
[CA]C:301 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
11644 |
3.8 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.047 |
72 |
|
[CA]A:301 |
1 |
1 |
85 |
◊ |
F |
x,y,z |
1_555 |
2 |
1 |
11105 |
3.6 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.047 |
73 |
|
[CA]D:301 |
1 |
1 |
85 |
◊ |
G |
x,y,z |
1_555 |
2 |
1 |
11014 |
3.4 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.047 |
74 |
|
[CA]H:301 |
1 |
1 |
85 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
11676 |
2.9 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.047 |
Average: |
4.0 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.047 |
|