## |
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 |
|
H |
282 |
75 |
13891 |
◊ |
G |
x,y,z |
1_555 |
280 |
72 |
13802 |
2886.4 |
-56.4 |
0.001 |
21 |
4 |
0 |
0.699 |
2 |
|
B |
278 |
74 |
13811 |
◊ |
A |
x,y,z |
1_555 |
278 |
74 |
13791 |
2875.1 |
-52.5 |
0.002 |
26 |
6 |
0 |
0.699 |
3 |
|
F |
263 |
66 |
13783 |
◊ |
E |
x,y,z |
1_555 |
252 |
67 |
13031 |
2584.9 |
-48.5 |
0.003 |
21 |
6 |
0 |
0.699 |
4 |
|
D |
250 |
65 |
13723 |
◊ |
C |
x,y,z |
1_555 |
250 |
66 |
13021 |
2566.0 |
-49.0 |
0.001 |
20 |
6 |
0 |
0.699 |
Average: |
2728.1 |
-51.6 |
0.002 |
22 |
6 |
0 |
0.699 |
2 |
5 |
|
[NAP]C:901 |
48 |
1 |
887 |
f |
C |
x,y,z |
1_555 |
92 |
32 |
13021 |
617.3 |
-5.1 |
0.592 |
16 |
0 |
0 |
0.306 |
6 |
|
[NAP]F:901 |
47 |
1 |
881 |
f |
F |
x,y,z |
1_555 |
93 |
33 |
13783 |
616.7 |
-5.0 |
0.615 |
18 |
0 |
0 |
0.306 |
7 |
|
[NAP]E:901 |
47 |
1 |
890 |
f |
E |
x,y,z |
1_555 |
86 |
32 |
13031 |
615.7 |
-5.1 |
0.576 |
18 |
0 |
0 |
0.306 |
8 |
|
[NAP]H:901 |
47 |
1 |
878 |
f |
H |
x,y,z |
1_555 |
93 |
32 |
13891 |
615.3 |
-5.7 |
0.577 |
18 |
0 |
0 |
0.306 |
9 |
|
[NAP]D:901 |
47 |
1 |
884 |
f |
D |
x,y,z |
1_555 |
91 |
32 |
13723 |
614.7 |
-5.3 |
0.583 |
16 |
0 |
0 |
0.306 |
10 |
|
[NAP]G:901 |
47 |
1 |
884 |
f |
G |
x,y,z |
1_555 |
83 |
32 |
13802 |
613.6 |
-5.4 |
0.569 |
17 |
0 |
0 |
0.306 |
11 |
|
[NAP]B:901 |
47 |
1 |
880 |
f |
B |
x,y,z |
1_555 |
88 |
31 |
13811 |
611.9 |
-5.8 |
0.561 |
19 |
0 |
0 |
0.306 |
12 |
|
[NAP]A:901 |
47 |
1 |
878 |
f |
A |
x,y,z |
1_555 |
89 |
32 |
13791 |
611.4 |
-5.7 |
0.563 |
20 |
0 |
0 |
0.306 |
Average: |
614.6 |
-5.4 |
0.580 |
18 |
0 |
0 |
0.306 |
3 |
13 |
|
H |
52 |
15 |
13891 |
◊ |
B |
-x+y+2/3,-x+4/3,z+1/3 |
9_565 |
56 |
15 |
13811 |
460.3 |
-4.3 |
0.516 |
2 |
0 |
0 |
0.000 |
14 |
|
C |
51 |
15 |
13021 |
◊ |
A |
x,y,z |
1_555 |
52 |
16 |
13791 |
429.0 |
-4.7 |
0.450 |
2 |
0 |
0 |
0.000 |
15 |
|
G |
49 |
14 |
13802 |
◊ |
E |
x,y,z |
1_555 |
47 |
13 |
13031 |
410.9 |
-3.1 |
0.569 |
2 |
0 |
0 |
0.000 |
Average: |
433.4 |
-4.1 |
0.512 |
2 |
0 |
0 |
0.000 |
4 |
16 |
|
[NN4]F:911 |
26 |
1 |
575 |
f |
F |
x,y,z |
1_555 |
60 |
23 |
13783 |
385.9 |
1.8 |
0.291 |
2 |
0 |
0 |
0.000 |
17 |
|
[NN4]D:911 |
26 |
1 |
577 |
f |
D |
x,y,z |
1_555 |
61 |
24 |
13723 |
382.2 |
2.3 |
0.325 |
2 |
0 |
0 |
0.000 |
18 |
|
[NN4]G:911 |
25 |
1 |
573 |
f |
G |
x,y,z |
1_555 |
56 |
23 |
13802 |
375.9 |
2.2 |
0.315 |
2 |
0 |
0 |
0.000 |
19 |
|
[NN4]A:911 |
25 |
1 |
573 |
f |
A |
x,y,z |
1_555 |
59 |
24 |
13791 |
375.6 |
2.1 |
0.330 |
2 |
0 |
0 |
0.000 |
20 |
|
[NN4]B:911 |
25 |
1 |
575 |
f |
B |
x,y,z |
1_555 |
60 |
24 |
13811 |
374.8 |
2.0 |
0.322 |
2 |
0 |
0 |
0.000 |
21 |
|
[NN4]E:911 |
26 |
1 |
572 |
f |
E |
x,y,z |
1_555 |
59 |
24 |
13031 |
374.7 |
1.5 |
0.283 |
2 |
0 |
0 |
0.000 |
22 |
|
[NN4]H:911 |
26 |
1 |
573 |
f |
H |
x,y,z |
1_555 |
58 |
23 |
13891 |
374.1 |
2.0 |
0.315 |
2 |
0 |
0 |
0.000 |
23 |
|
[NN4]C:911 |
26 |
1 |
574 |
f |
C |
x,y,z |
1_555 |
59 |
23 |
13021 |
363.6 |
1.9 |
0.327 |
2 |
0 |
0 |
0.000 |
Average: |
375.9 |
2.0 |
0.313 |
2 |
0 |
0 |
0.000 |
5 |
24 |
|
G |
45 |
12 |
13802 |
x |
G |
-y+1,x-y,z |
2_655 |
46 |
14 |
13802 |
382.3 |
0.5 |
0.813 |
4 |
0 |
0 |
0.000 |
25 |
|
A |
47 |
16 |
13791 |
x |
A |
-y+1,x-y,z |
2_655 |
46 |
11 |
13791 |
370.5 |
-1.0 |
0.742 |
2 |
0 |
0 |
0.000 |
Average: |
376.4 |
-0.2 |
0.778 |
3 |
0 |
0 |
0.000 |
6 |
26 |
|
D |
28 |
8 |
13723 |
◊ |
C |
-y+1,x-y,z |
2_655 |
30 |
11 |
13021 |
282.6 |
-1.5 |
0.618 |
3 |
1 |
0 |
0.000 |
27 |
|
E |
27 |
10 |
13031 |
◊ |
F |
-y+1,x-y,z |
2_655 |
26 |
8 |
13783 |
275.5 |
-1.5 |
0.603 |
3 |
1 |
0 |
0.000 |
Average: |
279.0 |
-1.5 |
0.611 |
3 |
1 |
0 |
0.000 |
7 |
28 |
|
F |
27 |
11 |
13783 |
◊ |
C |
x,y,z |
1_555 |
28 |
6 |
13021 |
254.8 |
-1.0 |
0.584 |
2 |
0 |
0 |
0.000 |
29 |
|
E |
23 |
6 |
13031 |
◊ |
D |
x,y,z |
1_555 |
26 |
11 |
13723 |
228.3 |
-1.4 |
0.569 |
1 |
0 |
0 |
0.000 |
Average: |
241.6 |
-1.2 |
0.576 |
2 |
0 |
0 |
0.000 |
8 |
30 |
|
[NN4]D:911 |
12 |
1 |
577 |
f |
[NAP]D:901 |
x,y,z |
1_555 |
17 |
1 |
884 |
105.9 |
-0.8 |
0.244 |
3 |
0 |
0 |
0.050 |
31 |
|
[NN4]C:911 |
12 |
1 |
574 |
f |
[NAP]C:901 |
x,y,z |
1_555 |
17 |
1 |
887 |
100.8 |
-0.8 |
0.240 |
3 |
0 |
0 |
0.050 |
32 |
|
[NN4]F:911 |
12 |
1 |
575 |
f |
[NAP]F:901 |
x,y,z |
1_555 |
18 |
1 |
881 |
100.3 |
-0.5 |
0.260 |
1 |
0 |
0 |
0.050 |
33 |
|
[NN4]E:911 |
11 |
1 |
572 |
f |
[NAP]E:901 |
x,y,z |
1_555 |
17 |
1 |
890 |
99.6 |
-0.8 |
0.246 |
3 |
0 |
0 |
0.050 |
34 |
|
[NN4]G:911 |
11 |
1 |
573 |
f |
[NAP]G:901 |
x,y,z |
1_555 |
16 |
1 |
884 |
97.6 |
-1.0 |
0.227 |
3 |
0 |
0 |
0.050 |
35 |
|
[NN4]H:911 |
12 |
1 |
573 |
f |
[NAP]H:901 |
x,y,z |
1_555 |
16 |
1 |
878 |
97.5 |
-0.7 |
0.246 |
3 |
0 |
0 |
0.050 |
36 |
|
[NN4]B:911 |
9 |
1 |
575 |
f |
[NAP]B:901 |
x,y,z |
1_555 |
16 |
1 |
880 |
96.8 |
-0.8 |
0.259 |
2 |
0 |
0 |
0.050 |
37 |
|
[NN4]A:911 |
10 |
1 |
573 |
f |
[NAP]A:901 |
x,y,z |
1_555 |
16 |
1 |
878 |
96.0 |
-0.8 |
0.260 |
2 |
0 |
0 |
0.050 |
Average: |
99.3 |
-0.8 |
0.248 |
3 |
0 |
0 |
0.050 |
9 |
38 |
|
E |
9 |
4 |
13031 |
◊ |
C |
x,y,z |
1_555 |
11 |
4 |
13021 |
88.6 |
-0.5 |
0.596 |
0 |
0 |
0 |
0.000 |
10 |
39 |
|
[NN4]H:911 |
5 |
1 |
573 |
◊ |
G |
x,y,z |
1_555 |
12 |
4 |
13802 |
46.8 |
0.0 |
0.393 |
0 |
0 |
0 |
0.000 |
40 |
|
[NN4]B:911 |
4 |
1 |
575 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
13791 |
46.2 |
0.4 |
0.362 |
0 |
0 |
0 |
0.000 |
41 |
|
[NN4]C:911 |
4 |
1 |
574 |
◊ |
D |
x,y,z |
1_555 |
8 |
3 |
13723 |
46.1 |
0.1 |
0.380 |
0 |
0 |
0 |
0.000 |
42 |
|
[NN4]E:911 |
4 |
1 |
572 |
◊ |
F |
x,y,z |
1_555 |
9 |
3 |
13783 |
44.5 |
0.2 |
0.425 |
0 |
0 |
0 |
0.000 |
43 |
|
[NN4]A:911 |
4 |
1 |
573 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
13811 |
44.0 |
0.3 |
0.375 |
0 |
0 |
0 |
0.000 |
44 |
|
[NN4]G:911 |
4 |
1 |
573 |
◊ |
H |
x,y,z |
1_555 |
9 |
3 |
13891 |
37.6 |
0.0 |
0.392 |
0 |
0 |
0 |
0.000 |
45 |
|
[NN4]F:911 |
1 |
1 |
575 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
13031 |
1.0 |
-0.0 |
0.437 |
0 |
0 |
0 |
0.000 |
Average: |
38.0 |
0.1 |
0.395 |
0 |
0 |
0 |
0.000 |
11 |
46 |
|
F |
5 |
3 |
13783 |
◊ |
D |
x,y,z |
1_555 |
5 |
3 |
13723 |
44.7 |
-1.4 |
0.229 |
0 |
0 |
0 |
0.000 |
12 |
47 |
|
F |
3 |
2 |
13783 |
◊ |
F |
x-y+2/3,-y+4/3,-z+4/3 |
11_566 |
3 |
2 |
13783 |
34.4 |
1.0 |
0.905 |
0 |
0 |
0 |
0.000 |
13 |
48 |
|
G |
3 |
1 |
13802 |
◊ |
B |
-x+y+2/3,-x+4/3,z+1/3 |
9_565 |
4 |
1 |
13811 |
18.6 |
0.4 |
0.792 |
0 |
0 |
0 |
0.000 |
49 |
|
C |
3 |
1 |
13021 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
13811 |
17.1 |
0.7 |
0.883 |
0 |
0 |
0 |
0.000 |
50 |
|
H |
3 |
1 |
13891 |
◊ |
A |
-x+y+2/3,-x+4/3,z+1/3 |
9_565 |
1 |
1 |
13791 |
12.5 |
0.4 |
0.776 |
0 |
0 |
0 |
0.000 |
51 |
|
H |
3 |
1 |
13891 |
◊ |
E |
x,y,z |
1_555 |
3 |
1 |
13031 |
8.3 |
0.2 |
0.743 |
0 |
0 |
0 |
0.000 |
52 |
|
D |
1 |
1 |
13723 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
13791 |
4.6 |
0.3 |
0.805 |
0 |
0 |
0 |
0.000 |
53 |
|
G |
3 |
2 |
13802 |
◊ |
F |
x,y,z |
1_555 |
2 |
2 |
13783 |
4.5 |
0.0 |
0.667 |
0 |
0 |
0 |
0.000 |
Average: |
10.9 |
0.3 |
0.778 |
0 |
0 |
0 |
0.000 |
14 |
54 |
|
[NN4]F:911 |
2 |
1 |
575 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
13021 |
13.9 |
0.5 |
0.597 |
0 |
0 |
0 |
0.000 |
55 |
|
[NN4]D:911 |
1 |
1 |
577 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
13031 |
4.0 |
0.2 |
0.575 |
0 |
0 |
0 |
0.000 |
Average: |
9.0 |
0.3 |
0.586 |
0 |
0 |
0 |
0.000 |
15 |
56 |
|
H |
3 |
3 |
13891 |
◊ |
F |
y-1/3,x-2/3,-z+4/3 |
10_446 |
4 |
2 |
13783 |
11.8 |
0.2 |
0.738 |
0 |
0 |
0 |
0.000 |
16 |
57 |
|
D |
1 |
1 |
13723 |
◊ |
B |
x-y,-y+1,-z+1 |
5_566 |
1 |
1 |
13811 |
8.3 |
0.4 |
0.874 |
0 |
0 |
0 |
0.000 |
17 |
58 |
|
C |
3 |
1 |
13021 |
x |
C |
-y+1,x-y,z |
2_655 |
2 |
2 |
13021 |
4.4 |
0.2 |
0.777 |
0 |
0 |
0 |
0.000 |
59 |
|
E |
1 |
1 |
13031 |
x |
E |
-y+1,x-y,z |
2_655 |
1 |
1 |
13031 |
1.5 |
0.1 |
0.791 |
0 |
0 |
0 |
0.000 |
Average: |
2.9 |
0.2 |
0.784 |
0 |
0 |
0 |
0.000 |
|