| ## |
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 |
172 |
44 |
23998 |
◊ |
A |
x,y,z |
1_555 |
162 |
38 |
24294 |
1656.0 |
-7.6 |
0.215 |
28 |
16 |
0 |
0.694 |
| 2 |
2 |
|
D |
150 |
42 |
9972 |
◊ |
C |
x,y,z |
1_555 |
135 |
31 |
23998 |
1392.8 |
-22.9 |
0.003 |
10 |
6 |
0 |
0.914 |
3 |
|
B |
151 |
41 |
10172 |
◊ |
A |
x,y,z |
1_555 |
136 |
33 |
24294 |
1389.4 |
-24.3 |
0.001 |
10 |
6 |
0 |
0.914 |
| Average: |
1391.1 |
-23.6 |
0.002 |
10 |
6 |
0 |
0.914 |
| 3 |
4 |
|
C |
64 |
24 |
23998 |
◊ |
A |
x-y,x,z+1/6 |
6_555 |
68 |
24 |
24294 |
663.0 |
3.1 |
0.744 |
13 |
3 |
0 |
0.000 |
| 4 |
5 |
|
B |
74 |
23 |
10172 |
◊ |
C |
x,y,z |
1_555 |
65 |
21 |
23998 |
612.1 |
-1.5 |
0.407 |
12 |
2 |
0 |
0.129 |
6 |
|
D |
71 |
23 |
9972 |
◊ |
A |
x,y,z |
1_555 |
65 |
22 |
24294 |
592.0 |
-2.9 |
0.323 |
10 |
0 |
0 |
0.129 |
| Average: |
602.1 |
-2.2 |
0.365 |
11 |
1 |
0 |
0.129 |
| 5 |
7 |
|
E |
66 |
6 |
2013 |
◊ |
A |
x,y,z |
1_555 |
72 |
24 |
24294 |
605.8 |
-5.5 |
0.438 |
11 |
0 |
0 |
0.178 |
8 |
|
F |
63 |
6 |
2064 |
◊ |
C |
x,y,z |
1_555 |
65 |
22 |
23998 |
559.0 |
-7.6 |
0.304 |
9 |
0 |
0 |
0.178 |
| Average: |
582.4 |
-6.5 |
0.371 |
10 |
0 |
0 |
0.178 |
| 6 |
9 |
|
G |
63 |
9 |
2913 |
◊ |
C |
x,y,z |
1_555 |
58 |
22 |
23998 |
497.8 |
-7.6 |
0.412 |
7 |
0 |
0 |
0.087 |
| 7 |
10 |
|
H |
48 |
7 |
2886 |
◊ |
A |
x,y,z |
1_555 |
45 |
18 |
24294 |
430.4 |
-4.9 |
0.376 |
7 |
0 |
0 |
0.065 |
| 8 |
11 |
|
G |
46 |
6 |
2913 |
◊ |
D |
x,y,z |
1_555 |
47 |
15 |
9972 |
400.3 |
-6.4 |
0.525 |
9 |
0 |
0 |
0.342 |
| 9 |
12 |
|
H |
46 |
6 |
2886 |
◊ |
B |
x,y,z |
1_555 |
45 |
15 |
10172 |
395.4 |
-7.0 |
0.411 |
10 |
0 |
0 |
0.366 |
| 10 |
13 |
|
G |
39 |
9 |
2913 |
◊ |
F |
x,y,z |
1_555 |
37 |
8 |
2064 |
370.8 |
-4.5 |
0.585 |
21 |
0 |
0 |
0.826 |
14 |
|
H |
40 |
7 |
2886 |
◊ |
E |
x,y,z |
1_555 |
35 |
8 |
2013 |
347.9 |
-3.2 |
0.592 |
20 |
0 |
0 |
0.826 |
| Average: |
359.3 |
-3.8 |
0.588 |
21 |
0 |
0 |
0.826 |
| 11 |
15 |
|
A |
41 |
11 |
24294 |
◊ |
C |
x,y-1,z |
1_545 |
44 |
15 |
23998 |
369.6 |
1.6 |
0.654 |
5 |
1 |
0 |
0.000 |
| 12 |
16 |
|
C |
31 |
9 |
23998 |
◊ |
B |
x-1,y-1,z |
1_445 |
19 |
4 |
10172 |
236.8 |
1.8 |
0.765 |
6 |
5 |
0 |
0.000 |
| 13 |
17 |
|
C |
26 |
6 |
23998 |
◊ |
E |
x-1,y-1,z |
1_445 |
21 |
2 |
2013 |
211.8 |
2.3 |
0.665 |
4 |
0 |
0 |
0.000 |
| 14 |
18 |
|
H |
21 |
4 |
2886 |
◊ |
G |
x,y,z |
1_555 |
22 |
5 |
2913 |
195.5 |
-2.4 |
0.598 |
10 |
0 |
0 |
0.103 |
| 15 |
19 |
|
H |
22 |
3 |
2886 |
◊ |
D |
x,y,z |
1_555 |
28 |
9 |
9972 |
189.8 |
-0.2 |
0.648 |
2 |
0 |
0 |
0.017 |
| 16 |
20 |
|
A |
21 |
8 |
24294 |
◊ |
G |
x,y-1,z |
1_545 |
18 |
2 |
2913 |
169.2 |
-1.9 |
0.553 |
1 |
0 |
0 |
0.000 |
| 17 |
21 |
|
[EVP]H:2101 |
26 |
1 |
743 |
◊ |
G |
x,y,z |
1_555 |
23 |
2 |
2913 |
167.4 |
5.2 |
0.698 |
1 |
0 |
0 |
0.000 |
| 18 |
22 |
|
[EVP]H:2101 |
19 |
1 |
743 |
◊ |
H |
x,y,z |
1_555 |
20 |
3 |
2886 |
152.3 |
2.3 |
0.494 |
2 |
0 |
0 |
0.000 |
| 19 |
23 |
|
[EVP]H:2101 |
17 |
1 |
743 |
f |
B |
x,y,z |
1_555 |
17 |
5 |
10172 |
146.1 |
0.1 |
0.359 |
2 |
0 |
0 |
0.024 |
| 20 |
24 |
|
E |
16 |
2 |
2013 |
◊ |
B |
x,y,z |
1_555 |
17 |
7 |
10172 |
145.0 |
2.2 |
0.643 |
2 |
0 |
0 |
0.000 |
25 |
|
F |
17 |
2 |
2064 |
◊ |
D |
x,y,z |
1_555 |
18 |
8 |
9972 |
143.7 |
2.3 |
0.720 |
2 |
0 |
0 |
0.000 |
| Average: |
144.3 |
2.2 |
0.681 |
2 |
0 |
0 |
0.000 |
| 21 |
26 |
|
A |
14 |
6 |
24294 |
◊ |
F |
x,y-1,z |
1_545 |
13 |
1 |
2064 |
133.4 |
2.2 |
0.719 |
2 |
0 |
0 |
0.000 |
| 22 |
27 |
|
C |
17 |
8 |
23998 |
◊ |
A |
x-1,y,z |
1_455 |
16 |
8 |
24294 |
109.1 |
0.5 |
0.595 |
1 |
0 |
0 |
0.000 |
| 23 |
28 |
|
G |
16 |
3 |
2913 |
◊ |
B |
x,y,z |
1_555 |
12 |
3 |
10172 |
106.8 |
0.6 |
0.765 |
2 |
0 |
0 |
0.005 |
| 24 |
29 |
|
C |
11 |
4 |
23998 |
◊ |
A |
x-1,y-1,z |
1_445 |
15 |
6 |
24294 |
100.3 |
0.8 |
0.684 |
1 |
0 |
0 |
0.000 |
| 25 |
30 |
|
A |
10 |
3 |
24294 |
◊ |
D |
x,y-1,z |
1_545 |
7 |
2 |
9972 |
95.3 |
2.4 |
0.853 |
4 |
3 |
0 |
0.000 |
| 26 |
31 |
|
[EVP]H:2101 |
13 |
1 |
743 |
◊ |
E |
x,y,z |
1_555 |
13 |
1 |
2013 |
88.9 |
1.2 |
0.491 |
0 |
0 |
0 |
0.000 |
| 27 |
32 |
|
C |
9 |
3 |
23998 |
◊ |
H |
x-1,y-1,z |
1_445 |
11 |
2 |
2886 |
87.7 |
2.8 |
0.849 |
0 |
0 |
0 |
0.000 |
| 28 |
33 |
|
H |
17 |
1 |
2886 |
◊ |
F |
x,y,z |
1_555 |
13 |
1 |
2064 |
81.8 |
2.2 |
0.775 |
0 |
0 |
0 |
0.000 |
| 29 |
34 |
|
[NA]A:501 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
24294 |
63.8 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.306 |
| 30 |
35 |
|
[MN]B:1001 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
10172 |
60.6 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.127 |
| 31 |
36 |
|
[EVP]H:2101 |
6 |
1 |
743 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
24294 |
47.7 |
0.7 |
0.582 |
0 |
0 |
0 |
0.000 |
| 32 |
37 |
|
[MN]D:701 |
1 |
1 |
123 |
f |
D |
x,y,z |
1_555 |
7 |
5 |
9972 |
45.1 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.100 |
| 33 |
38 |
|
[MN]G:2101 |
1 |
1 |
123 |
f |
G |
x,y,z |
1_555 |
6 |
2 |
2913 |
44.2 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.174 |
| 34 |
39 |
|
[NA]H:2102 |
1 |
1 |
125 |
f |
H |
x,y,z |
1_555 |
7 |
2 |
2886 |
41.0 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.309 |
| 35 |
40 |
|
G |
3 |
1 |
2913 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
24294 |
34.5 |
-1.5 |
0.317 |
0 |
0 |
0 |
0.012 |
| 36 |
41 |
|
F |
7 |
1 |
2064 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
24294 |
33.4 |
0.1 |
0.604 |
1 |
0 |
0 |
0.007 |
42 |
|
E |
7 |
1 |
2013 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
23998 |
31.5 |
0.0 |
0.609 |
1 |
0 |
0 |
0.007 |
| Average: |
32.4 |
0.0 |
0.607 |
1 |
0 |
0 |
0.007 |
| 37 |
43 |
|
[MN]D:701 |
1 |
1 |
123 |
◊ |
F |
x,y,z |
1_555 |
4 |
1 |
2064 |
29.8 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.065 |
| 38 |
44 |
|
[NA]H:2102 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
2 |
2 |
23998 |
28.9 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.024 |
| 39 |
45 |
|
[EVP]H:2101 |
5 |
1 |
743 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
23998 |
28.4 |
0.5 |
0.541 |
0 |
0 |
0 |
0.000 |
| 40 |
46 |
|
[NA]H:2102 |
1 |
1 |
125 |
◊ |
F |
x,y,z |
1_555 |
6 |
1 |
2064 |
26.4 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.049 |
| 41 |
47 |
|
[MN]G:2101 |
1 |
1 |
123 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
24294 |
26.4 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.012 |
48 |
|
[MN]G:2101 |
1 |
1 |
123 |
◊ |
C |
x,y,z |
1_555 |
2 |
2 |
23998 |
4.9 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.012 |
| Average: |
15.7 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.012 |
| 42 |
49 |
|
[MN]B:1001 |
1 |
1 |
123 |
◊ |
E |
x,y,z |
1_555 |
5 |
1 |
2013 |
21.4 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.046 |
| 43 |
50 |
|
[MN]D:701 |
1 |
1 |
123 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
24294 |
16.7 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.012 |
51 |
|
[MN]B:1001 |
1 |
1 |
123 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
23998 |
8.6 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.012 |
| Average: |
12.7 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.012 |
| 44 |
52 |
|
[MN]D:701 |
1 |
1 |
123 |
◊ |
H |
x,y,z |
1_555 |
3 |
1 |
2886 |
16.1 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.011 |
| 45 |
53 |
|
[NA]H:2102 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
24294 |
12.6 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.009 |
| 46 |
54 |
|
[EVP]H:2101 |
2 |
1 |
743 |
◊ |
[MN]G:2101 |
x,y,z |
1_555 |
1 |
1 |
123 |
11.6 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.003 |
| 47 |
55 |
|
A |
3 |
2 |
24294 |
x |
A |
x-y,x-1,z+1/6 |
6_545 |
3 |
3 |
24294 |
9.6 |
0.1 |
0.639 |
0 |
0 |
0 |
0.000 |
| 48 |
56 |
|
C |
1 |
1 |
23998 |
◊ |
[NA]A:501 |
x-1,y-1,z |
1_445 |
1 |
1 |
125 |
9.2 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.000 |
| 49 |
57 |
|
A |
1 |
1 |
24294 |
◊ |
B |
x-1,y-1,z |
1_445 |
1 |
1 |
10172 |
5.4 |
0.1 |
0.522 |
0 |
0 |
0 |
0.000 |
| 50 |
58 |
|
[MN]B:1001 |
1 |
1 |
123 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
24294 |
1.9 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.002 |
|