## |
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 |
|
D |
106 |
26 |
5966 |
◊ |
C |
x,y,z |
1_555 |
108 |
26 |
5946 |
1117.5 |
-13.4 |
0.748 |
58 |
0 |
0 |
1.000 |
2 |
|
H |
109 |
26 |
5974 |
◊ |
G |
x,y,z |
1_555 |
108 |
26 |
5947 |
1114.6 |
-13.8 |
0.742 |
60 |
0 |
0 |
1.000 |
Average: |
1116.0 |
-13.6 |
0.745 |
59 |
0 |
0 |
1.000 |
2 |
3 |
|
F |
88 |
25 |
11316 |
◊ |
E |
x,y,z |
1_555 |
74 |
24 |
11929 |
803.3 |
-3.5 |
0.368 |
12 |
8 |
0 |
0.197 |
3 |
4 |
|
B |
74 |
21 |
11649 |
◊ |
A |
x,y,z |
1_555 |
79 |
28 |
11370 |
748.6 |
-6.4 |
0.176 |
6 |
3 |
0 |
0.158 |
4 |
5 |
|
F |
63 |
17 |
11316 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
63 |
16 |
11370 |
582.3 |
-0.1 |
0.538 |
5 |
3 |
0 |
0.003 |
5 |
6 |
|
C |
49 |
9 |
5946 |
◊ |
B |
x,y,z |
1_555 |
48 |
17 |
11649 |
462.4 |
-7.3 |
0.443 |
9 |
0 |
0 |
0.194 |
7 |
|
G |
48 |
9 |
5947 |
◊ |
F |
x,y,z |
1_555 |
49 |
17 |
11316 |
456.4 |
-6.3 |
0.499 |
10 |
0 |
0 |
0.194 |
Average: |
459.4 |
-6.8 |
0.471 |
10 |
0 |
0 |
0.194 |
6 |
8 |
|
C |
48 |
10 |
5946 |
◊ |
A |
x,y,z |
1_555 |
48 |
17 |
11370 |
457.6 |
-6.0 |
0.509 |
12 |
0 |
0 |
0.373 |
9 |
|
G |
50 |
10 |
5947 |
◊ |
E |
x,y,z |
1_555 |
49 |
17 |
11929 |
445.3 |
-5.2 |
0.538 |
10 |
0 |
0 |
0.373 |
Average: |
451.5 |
-5.6 |
0.523 |
11 |
0 |
0 |
0.373 |
7 |
10 |
|
D |
53 |
11 |
5966 |
◊ |
B |
x,y,z |
1_555 |
51 |
17 |
11649 |
445.1 |
-4.4 |
0.602 |
8 |
0 |
0 |
0.164 |
11 |
|
H |
50 |
9 |
5974 |
◊ |
F |
x,y,z |
1_555 |
52 |
17 |
11316 |
436.0 |
-4.8 |
0.539 |
8 |
0 |
0 |
0.164 |
Average: |
440.5 |
-4.6 |
0.570 |
8 |
0 |
0 |
0.164 |
8 |
12 |
|
D |
52 |
8 |
5966 |
◊ |
A |
x,y,z |
1_555 |
47 |
16 |
11370 |
440.9 |
-3.9 |
0.577 |
9 |
0 |
0 |
0.101 |
9 |
13 |
|
H |
48 |
8 |
5974 |
◊ |
E |
x,y,z |
1_555 |
47 |
16 |
11929 |
411.1 |
-3.4 |
0.592 |
9 |
0 |
0 |
0.145 |
10 |
14 |
|
E |
41 |
12 |
11929 |
◊ |
B |
-x-1,y-1/2,-z-1/2 |
3_444 |
53 |
16 |
11649 |
407.9 |
-3.8 |
0.260 |
3 |
1 |
0 |
0.055 |
11 |
15 |
|
E |
34 |
10 |
11929 |
◊ |
A |
-x-3/2,-y,z-1/2 |
2_354 |
31 |
12 |
11370 |
315.2 |
-2.8 |
0.277 |
3 |
4 |
0 |
0.000 |
12 |
16 |
|
E |
29 |
8 |
11929 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
32 |
11 |
11370 |
286.4 |
0.7 |
0.636 |
10 |
5 |
0 |
0.019 |
13 |
17 |
|
F |
13 |
4 |
11316 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
18 |
4 |
11649 |
127.6 |
2.4 |
0.832 |
3 |
0 |
0 |
0.000 |
14 |
18 |
|
[EDO]B:303 |
4 |
1 |
187 |
◊ |
B |
x,y,z |
1_555 |
25 |
10 |
11649 |
113.5 |
3.4 |
0.442 |
1 |
0 |
0 |
0.000 |
15 |
19 |
|
E |
14 |
6 |
11929 |
x |
E |
-x-2,y-1/2,-z-1/2 |
3_344 |
12 |
5 |
11929 |
110.1 |
0.2 |
0.592 |
0 |
0 |
0 |
0.000 |
16 |
20 |
|
C |
14 |
1 |
5946 |
x |
C |
-x-1/2,-y,z-1/2 |
2_454 |
15 |
1 |
5946 |
106.8 |
3.0 |
0.859 |
0 |
0 |
0 |
0.000 |
17 |
21 |
|
[CAC]E:303 |
5 |
1 |
231 |
◊ |
E |
x,y,z |
1_555 |
18 |
4 |
11929 |
105.8 |
3.1 |
0.346 |
0 |
0 |
0 |
0.000 |
18 |
22 |
|
[EDO]E:302 |
4 |
1 |
187 |
f |
E |
x,y,z |
1_555 |
19 |
8 |
11929 |
105.7 |
2.5 |
0.410 |
5 |
0 |
0 |
0.000 |
19 |
23 |
|
G |
16 |
1 |
5947 |
x |
G |
-x-3/2,-y,z-1/2 |
2_354 |
13 |
1 |
5947 |
103.6 |
2.6 |
0.838 |
0 |
0 |
0 |
0.000 |
20 |
24 |
|
[EDO]A:302 |
4 |
1 |
187 |
◊ |
A |
x,y,z |
1_555 |
19 |
8 |
11370 |
103.5 |
2.7 |
0.430 |
4 |
0 |
0 |
0.000 |
21 |
25 |
|
[EDO]A:303 |
4 |
1 |
187 |
◊ |
A |
x,y,z |
1_555 |
18 |
8 |
11370 |
103.1 |
3.1 |
0.398 |
2 |
0 |
0 |
0.000 |
22 |
26 |
|
H |
12 |
3 |
5974 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
9 |
4 |
11649 |
96.3 |
-2.5 |
0.255 |
0 |
0 |
0 |
0.011 |
23 |
27 |
|
G |
10 |
3 |
5947 |
◊ |
H |
-x-3/2,-y,z-1/2 |
2_354 |
12 |
3 |
5974 |
90.9 |
-0.8 |
0.602 |
4 |
0 |
0 |
0.000 |
24 |
28 |
|
H |
13 |
1 |
5974 |
x |
H |
-x-3/2,-y,z-1/2 |
2_354 |
13 |
1 |
5974 |
89.8 |
2.0 |
0.785 |
0 |
0 |
0 |
0.000 |
25 |
29 |
|
D |
13 |
1 |
5966 |
x |
D |
-x-1/2,-y,z-1/2 |
2_454 |
13 |
1 |
5966 |
89.5 |
2.1 |
0.797 |
0 |
0 |
0 |
0.000 |
26 |
30 |
|
D |
11 |
2 |
5966 |
◊ |
C |
-x-1/2,-y,z-1/2 |
2_454 |
10 |
2 |
5946 |
87.5 |
-0.2 |
0.635 |
4 |
0 |
0 |
0.000 |
27 |
31 |
|
F |
9 |
3 |
11316 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
7 |
3 |
11370 |
86.4 |
0.8 |
0.739 |
4 |
0 |
0 |
0.004 |
28 |
32 |
|
G |
10 |
2 |
5947 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
11649 |
77.7 |
-2.5 |
0.303 |
1 |
0 |
0 |
0.000 |
29 |
33 |
|
F |
8 |
4 |
11316 |
◊ |
D |
x-1/2,-y-1/2,-z |
4_445 |
9 |
2 |
5966 |
76.9 |
-1.9 |
0.444 |
2 |
0 |
0 |
0.003 |
30 |
34 |
|
F |
11 |
3 |
11316 |
◊ |
C |
x-1/2,-y-1/2,-z |
4_445 |
9 |
3 |
5946 |
74.2 |
-2.0 |
0.430 |
1 |
0 |
0 |
0.002 |
31 |
35 |
|
[EDO]A:302 |
3 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
11649 |
55.3 |
0.8 |
0.156 |
0 |
0 |
0 |
0.000 |
32 |
36 |
|
E |
9 |
3 |
11929 |
f |
[CAC]E:303 |
-x-2,y-1/2,-z-1/2 |
3_344 |
4 |
1 |
231 |
52.6 |
1.1 |
0.244 |
0 |
0 |
0 |
0.000 |
33 |
37 |
|
E |
6 |
3 |
11929 |
◊ |
C |
x-1,y,z |
1_455 |
7 |
3 |
5946 |
51.7 |
-2.5 |
0.293 |
0 |
0 |
0 |
0.000 |
34 |
38 |
|
A |
5 |
2 |
11370 |
◊ |
D |
x-1/2,-y+1/2,-z |
4_455 |
8 |
2 |
5966 |
47.2 |
-0.3 |
0.602 |
2 |
0 |
0 |
0.000 |
35 |
39 |
|
[CA]F:302 |
1 |
1 |
85 |
f |
F |
x,y,z |
1_555 |
9 |
6 |
11316 |
47.2 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.424 |
40 |
|
[CA]E:301 |
1 |
1 |
85 |
f |
E |
x,y,z |
1_555 |
9 |
5 |
11929 |
46.2 |
-10.6 |
0.000 |
0 |
0 |
0 |
0.424 |
41 |
|
[CA]A:301 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
11370 |
46.0 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.424 |
42 |
|
[CA]B:301 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
11649 |
44.7 |
-10.6 |
0.000 |
0 |
0 |
0 |
0.424 |
Average: |
46.0 |
-10.7 |
0.000 |
0 |
0 |
0 |
0.424 |
36 |
43 |
|
E |
5 |
2 |
11929 |
f |
[EDO]A:303 |
x-1/2,-y+1/2,-z |
4_455 |
3 |
1 |
187 |
41.4 |
0.9 |
0.748 |
1 |
0 |
0 |
0.000 |
37 |
44 |
|
[EDO]B:303 |
4 |
1 |
187 |
f |
D |
x,y,z |
1_555 |
5 |
1 |
5966 |
37.3 |
-0.4 |
0.549 |
0 |
0 |
0 |
0.100 |
38 |
45 |
|
E |
5 |
2 |
11929 |
◊ |
C |
-x-1,y-1/2,-z-1/2 |
3_444 |
8 |
2 |
5946 |
37.1 |
-0.4 |
0.602 |
0 |
0 |
0 |
0.004 |
39 |
46 |
|
E |
6 |
2 |
11929 |
f |
[CA]B:302 |
-x-1,y-1/2,-z-1/2 |
3_444 |
1 |
1 |
85 |
30.8 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.106 |
40 |
47 |
|
[CA]B:302 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
11649 |
28.2 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.046 |
41 |
48 |
|
[CA]F:301 |
1 |
1 |
85 |
◊ |
F |
x,y,z |
1_555 |
3 |
1 |
11316 |
27.4 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.004 |
42 |
49 |
|
G |
4 |
2 |
5947 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
4 |
4 |
11649 |
27.3 |
-0.1 |
0.605 |
0 |
0 |
0 |
0.000 |
43 |
50 |
|
[CA]F:301 |
1 |
1 |
85 |
f |
C |
x-1/2,-y-1/2,-z |
4_445 |
3 |
2 |
5946 |
26.6 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.179 |
44 |
51 |
|
[CA]F:301 |
1 |
1 |
85 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
7 |
4 |
11370 |
18.5 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.091 |
45 |
52 |
|
F |
1 |
1 |
11316 |
◊ |
D |
x-1,y,z |
1_455 |
3 |
2 |
5966 |
11.0 |
0.0 |
0.622 |
0 |
0 |
0 |
0.000 |
46 |
53 |
|
H |
2 |
1 |
5974 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
11370 |
6.4 |
-0.3 |
0.420 |
0 |
0 |
0 |
0.000 |
47 |
54 |
|
G |
1 |
1 |
5947 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
11370 |
4.5 |
0.1 |
0.457 |
0 |
0 |
0 |
0.000 |
48 |
55 |
|
E |
1 |
1 |
11929 |
◊ |
D |
-x-1,y-1/2,-z-1/2 |
3_444 |
1 |
1 |
5966 |
1.1 |
-0.0 |
0.437 |
0 |
0 |
0 |
0.000 |
49 |
56 |
|
H |
1 |
1 |
5974 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
11649 |
0.6 |
-0.0 |
0.410 |
0 |
0 |
0 |
0.000 |
|