| ## |
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 |
|
C |
398 |
104 |
31831 |
◊ |
A |
x,y,z |
1_555 |
376 |
95 |
31442 |
3929.2 |
-47.1 |
0.005 |
30 |
21 |
0 |
0.844 |
| 2 |
2 |
|
B |
211 |
58 |
16355 |
◊ |
A |
x,y,z |
1_555 |
199 |
57 |
31442 |
1873.8 |
-7.5 |
0.551 |
33 |
13 |
0 |
0.845 |
3 |
|
D |
205 |
53 |
16265 |
◊ |
C |
x,y,z |
1_555 |
195 |
51 |
31831 |
1865.5 |
-5.0 |
0.635 |
33 |
15 |
0 |
0.845 |
| Average: |
1869.7 |
-6.3 |
0.593 |
33 |
14 |
0 |
0.845 |
| 3 |
4 |
|
M |
165 |
39 |
9362 |
◊ |
G |
x,y,z |
1_555 |
180 |
40 |
9151 |
1702.2 |
-18.2 |
0.848 |
87 |
0 |
0 |
0.467 |
| 4 |
5 |
|
F |
133 |
30 |
6859 |
◊ |
L |
x,y,z |
1_555 |
133 |
29 |
6871 |
1281.0 |
-16.7 |
0.733 |
75 |
0 |
0 |
0.429 |
| 5 |
6 |
|
F |
119 |
17 |
6859 |
◊ |
C |
x,y,z |
1_555 |
113 |
31 |
31831 |
1046.0 |
-15.3 |
0.631 |
20 |
0 |
0 |
0.464 |
| 6 |
7 |
|
L |
111 |
19 |
6871 |
◊ |
C |
x,y,z |
1_555 |
101 |
32 |
31831 |
973.0 |
-8.3 |
0.630 |
18 |
0 |
0 |
0.194 |
| 7 |
8 |
|
G |
105 |
17 |
9151 |
◊ |
A |
x,y,z |
1_555 |
104 |
30 |
31442 |
874.8 |
-14.9 |
0.582 |
13 |
0 |
0 |
0.462 |
| 8 |
9 |
|
M |
100 |
17 |
9362 |
◊ |
A |
x,y,z |
1_555 |
87 |
25 |
31442 |
833.9 |
-10.0 |
0.544 |
13 |
0 |
0 |
0.238 |
| 9 |
10 |
|
J |
92 |
11 |
5809 |
◊ |
C |
x,y,z |
1_555 |
101 |
34 |
31831 |
812.8 |
-8.4 |
0.573 |
13 |
0 |
0 |
0.739 |
11 |
|
I |
99 |
13 |
5989 |
◊ |
A |
x,y,z |
1_555 |
108 |
30 |
31442 |
799.8 |
-11.6 |
0.470 |
14 |
0 |
0 |
0.739 |
| Average: |
806.3 |
-10.0 |
0.521 |
14 |
0 |
0 |
0.739 |
| 10 |
12 |
|
M |
80 |
9 |
9362 |
◊ |
C |
x,y,z |
1_555 |
87 |
27 |
31831 |
713.8 |
-4.9 |
0.668 |
10 |
0 |
0 |
0.091 |
| 11 |
13 |
|
L |
77 |
9 |
6871 |
◊ |
A |
x,y,z |
1_555 |
89 |
29 |
31442 |
692.2 |
-7.9 |
0.574 |
8 |
0 |
0 |
0.109 |
| 12 |
14 |
|
F |
73 |
11 |
6859 |
◊ |
A |
x,y,z |
1_555 |
81 |
28 |
31442 |
633.5 |
-4.9 |
0.792 |
12 |
0 |
0 |
0.526 |
| 13 |
15 |
|
G |
74 |
12 |
9151 |
◊ |
C |
x,y,z |
1_555 |
87 |
30 |
31831 |
615.4 |
-6.8 |
0.756 |
14 |
0 |
0 |
0.593 |
| 14 |
16 |
|
M |
81 |
10 |
9362 |
◊ |
N |
x,y,z |
1_555 |
58 |
19 |
9156 |
602.9 |
-2.9 |
0.321 |
4 |
0 |
0 |
0.021 |
| 15 |
17 |
|
G |
85 |
11 |
9151 |
◊ |
N |
x,y,z |
1_555 |
60 |
23 |
9156 |
573.2 |
-8.7 |
0.588 |
2 |
0 |
0 |
0.042 |
| 16 |
18 |
|
B |
55 |
16 |
16355 |
◊ |
C |
x,y,z |
1_555 |
44 |
15 |
31831 |
412.8 |
-2.5 |
0.504 |
3 |
1 |
0 |
0.016 |
19 |
|
D |
43 |
13 |
16265 |
◊ |
A |
x,y,z |
1_555 |
40 |
13 |
31442 |
366.2 |
-3.2 |
0.390 |
1 |
0 |
0 |
0.016 |
| Average: |
389.5 |
-2.8 |
0.447 |
2 |
1 |
0 |
0.016 |
| 17 |
20 |
|
J |
40 |
9 |
5809 |
◊ |
D |
x,y,z |
1_555 |
42 |
11 |
16265 |
344.2 |
-10.6 |
0.197 |
3 |
0 |
0 |
1.000 |
| 18 |
21 |
|
J |
29 |
3 |
5809 |
◊ |
I |
-x-1,y-1/2,-z-1 |
2_444 |
29 |
4 |
5989 |
212.9 |
2.1 |
0.782 |
1 |
0 |
0 |
0.000 |
| 19 |
22 |
|
I |
27 |
7 |
5989 |
◊ |
B |
x,y,z |
1_555 |
22 |
8 |
16355 |
207.1 |
-7.4 |
0.212 |
2 |
0 |
0 |
0.110 |
| 20 |
23 |
|
C |
31 |
8 |
31831 |
◊ |
L |
x-1,y,z |
1_455 |
23 |
2 |
6871 |
203.7 |
0.0 |
0.631 |
5 |
0 |
0 |
0.000 |
| 21 |
24 |
|
D |
21 |
9 |
16265 |
◊ |
A |
-x,y-1/2,-z-1 |
2_544 |
23 |
7 |
31442 |
194.8 |
-2.5 |
0.306 |
1 |
0 |
0 |
0.000 |
| 22 |
25 |
|
D |
17 |
7 |
16265 |
◊ |
A |
x,y-1,z |
1_545 |
21 |
3 |
31442 |
165.5 |
-2.8 |
0.194 |
3 |
0 |
0 |
0.000 |
| 23 |
26 |
|
C |
18 |
8 |
31831 |
◊ |
B |
x,y-1,z |
1_545 |
17 |
5 |
16355 |
148.7 |
-1.9 |
0.342 |
1 |
0 |
0 |
0.000 |
| 24 |
27 |
|
C |
15 |
6 |
31831 |
◊ |
F |
x-1,y,z |
1_455 |
18 |
4 |
6859 |
131.7 |
-1.5 |
0.500 |
1 |
0 |
0 |
0.000 |
| 25 |
28 |
|
[EDO]A:2005 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
25 |
12 |
31442 |
119.1 |
3.8 |
0.643 |
3 |
0 |
0 |
0.000 |
| 26 |
29 |
|
N |
15 |
6 |
9156 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
16 |
4 |
31442 |
112.6 |
-0.3 |
0.699 |
1 |
0 |
0 |
0.000 |
| 27 |
30 |
|
[EDO]A:2004 |
4 |
1 |
182 |
◊ |
B |
x,y,z |
1_555 |
21 |
9 |
16355 |
107.7 |
2.3 |
0.417 |
2 |
0 |
0 |
0.000 |
| 28 |
31 |
|
[EDO]C:2004 |
4 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
16 |
7 |
31831 |
101.7 |
2.5 |
0.455 |
2 |
0 |
0 |
0.000 |
| 29 |
32 |
|
[K]A:2006 |
1 |
1 |
216 |
f |
L |
x,y,z |
1_555 |
18 |
3 |
6871 |
79.2 |
-46.5 |
0.000 |
0 |
0 |
0 |
0.554 |
| 30 |
33 |
|
[K]C:2005 |
1 |
1 |
216 |
f |
M |
x,y,z |
1_555 |
13 |
3 |
9362 |
76.7 |
-44.7 |
0.000 |
0 |
0 |
0 |
0.674 |
| 31 |
34 |
|
[K]A:2006 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
16 |
6 |
31442 |
73.7 |
-40.7 |
0.000 |
0 |
0 |
0 |
0.415 |
35 |
|
[K]C:2005 |
1 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
14 |
6 |
31831 |
72.2 |
-42.5 |
0.000 |
0 |
0 |
0 |
0.415 |
| Average: |
72.9 |
-41.6 |
0.000 |
0 |
0 |
0 |
0.415 |
| 32 |
36 |
|
[MN]A:2003 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
31442 |
55.3 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.188 |
37 |
|
[MN]C:2002 |
1 |
1 |
123 |
f |
C |
x,y,z |
1_555 |
8 |
7 |
31831 |
45.8 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.188 |
| Average: |
50.5 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.188 |
| 33 |
38 |
|
[EDO]A:2004 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
31442 |
54.0 |
1.5 |
0.858 |
2 |
0 |
0 |
0.000 |
| 34 |
39 |
|
[K]C:2005 |
1 |
1 |
216 |
◊ |
G |
x,y,z |
1_555 |
7 |
3 |
9151 |
48.5 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.167 |
| 35 |
40 |
|
[K]A:2006 |
1 |
1 |
216 |
◊ |
F |
x,y,z |
1_555 |
7 |
3 |
6859 |
48.1 |
-20.0 |
0.000 |
0 |
0 |
0 |
0.172 |
| 36 |
41 |
|
[MN]A:2002 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
31442 |
46.9 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.159 |
42 |
|
[MN]C:2003 |
1 |
1 |
123 |
f |
C |
x,y,z |
1_555 |
10 |
7 |
31831 |
44.5 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.159 |
| Average: |
45.7 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.159 |
| 37 |
43 |
|
[MN]A:2002 |
1 |
1 |
123 |
◊ |
F |
x,y,z |
1_555 |
6 |
1 |
6859 |
37.5 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.139 |
| 38 |
44 |
|
[MN]C:2003 |
1 |
1 |
123 |
◊ |
G |
x,y,z |
1_555 |
8 |
2 |
9151 |
35.7 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.096 |
| 39 |
45 |
|
C |
2 |
1 |
31831 |
x |
C |
x-1,y,z |
1_455 |
3 |
1 |
31831 |
32.1 |
-1.0 |
0.141 |
0 |
0 |
0 |
0.000 |
| 40 |
46 |
|
[MN]C:2002 |
1 |
1 |
123 |
◊ |
J |
x,y,z |
1_555 |
7 |
2 |
5809 |
28.8 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.043 |
47 |
|
[MN]A:2003 |
1 |
1 |
123 |
◊ |
I |
x,y,z |
1_555 |
3 |
1 |
5989 |
14.4 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.043 |
| Average: |
21.6 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.043 |
| 41 |
48 |
|
N |
3 |
1 |
9156 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
4 |
1 |
16355 |
25.3 |
-0.3 |
0.517 |
0 |
0 |
0 |
0.000 |
| 42 |
49 |
|
D |
3 |
1 |
16265 |
◊ |
B |
x,y-1,z |
1_545 |
3 |
1 |
16355 |
23.7 |
-0.3 |
0.401 |
0 |
0 |
0 |
0.000 |
| 43 |
50 |
|
[MN]A:2003 |
1 |
1 |
123 |
f |
[MN]A:2002 |
x,y,z |
1_555 |
1 |
1 |
123 |
21.0 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.107 |
| 44 |
51 |
|
G |
4 |
1 |
9151 |
◊ |
J |
x,y,z |
1_555 |
4 |
2 |
5809 |
20.1 |
0.5 |
0.628 |
0 |
0 |
0 |
0.000 |
| 45 |
52 |
|
[MN]C:2003 |
1 |
1 |
123 |
f |
[MN]C:2002 |
x,y,z |
1_555 |
1 |
1 |
123 |
18.0 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.085 |
| 46 |
53 |
|
[MN]C:2002 |
1 |
1 |
123 |
◊ |
G |
x,y,z |
1_555 |
1 |
1 |
9151 |
13.3 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.041 |
| 47 |
54 |
|
[MN]A:2003 |
1 |
1 |
123 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
6859 |
10.0 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.036 |
| 48 |
55 |
|
[MN]C:2003 |
1 |
1 |
123 |
◊ |
J |
x,y,z |
1_555 |
1 |
1 |
5809 |
3.7 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.003 |
| 49 |
56 |
|
G |
1 |
1 |
9151 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
31831 |
2.3 |
-0.2 |
0.342 |
0 |
0 |
0 |
0.000 |
|