## |
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 |
|
J |
78 |
22 |
6556 |
◊ |
B |
-y+1/2,x+1/2,z+1/4 |
3_555 |
80 |
24 |
6656 |
673.7 |
-5.4 |
0.413 |
12 |
0 |
0 |
0.094 |
2 |
|
H |
78 |
22 |
6673 |
◊ |
A |
-y+1/2,x-1/2,z+1/4 |
3_545 |
73 |
20 |
6576 |
662.6 |
-6.7 |
0.372 |
11 |
0 |
0 |
0.094 |
Average: |
668.1 |
-6.0 |
0.393 |
12 |
0 |
0 |
0.094 |
2 |
3 |
|
E |
61 |
21 |
6767 |
◊ |
B |
x,y,z |
1_555 |
68 |
22 |
6656 |
625.0 |
-0.8 |
0.657 |
17 |
0 |
0 |
0.000 |
4 |
|
L |
61 |
19 |
6778 |
◊ |
H |
x,y,z |
1_555 |
70 |
21 |
6673 |
620.4 |
-0.8 |
0.669 |
17 |
0 |
0 |
0.000 |
5 |
|
F |
71 |
23 |
6604 |
◊ |
C |
x,y,z |
1_555 |
61 |
19 |
6589 |
616.6 |
-0.9 |
0.691 |
16 |
0 |
0 |
0.000 |
6 |
|
N |
59 |
19 |
6607 |
◊ |
M |
x,y,z |
1_555 |
67 |
20 |
6588 |
611.4 |
-1.4 |
0.662 |
16 |
0 |
0 |
0.000 |
7 |
|
K |
67 |
21 |
6589 |
◊ |
J |
x,y,z |
1_555 |
59 |
20 |
6556 |
609.8 |
0.1 |
0.771 |
16 |
0 |
0 |
0.000 |
8 |
|
G |
65 |
21 |
6285 |
◊ |
B |
x,y,z |
1_555 |
57 |
18 |
6656 |
609.5 |
-0.9 |
0.676 |
15 |
0 |
0 |
0.000 |
9 |
|
D |
63 |
20 |
6534 |
◊ |
A |
x,y,z |
1_555 |
58 |
18 |
6576 |
606.0 |
-0.9 |
0.767 |
15 |
0 |
0 |
0.000 |
10 |
|
I |
65 |
21 |
6226 |
◊ |
H |
x,y,z |
1_555 |
57 |
18 |
6673 |
605.7 |
-0.7 |
0.704 |
17 |
0 |
0 |
0.000 |
11 |
|
M |
57 |
18 |
6588 |
◊ |
J |
x,y,z |
1_555 |
66 |
20 |
6556 |
602.9 |
-1.8 |
0.647 |
14 |
0 |
0 |
0.000 |
12 |
|
G |
56 |
18 |
6285 |
◊ |
C |
x,y,z |
1_555 |
65 |
20 |
6589 |
596.4 |
-1.3 |
0.741 |
15 |
0 |
0 |
0.000 |
13 |
|
N |
68 |
21 |
6607 |
◊ |
I |
x,y,z |
1_555 |
57 |
18 |
6226 |
594.4 |
-1.4 |
0.765 |
15 |
0 |
0 |
0.000 |
14 |
|
F |
59 |
17 |
6604 |
◊ |
A |
x,y,z |
1_555 |
62 |
20 |
6576 |
584.4 |
-2.6 |
0.641 |
14 |
0 |
0 |
0.000 |
15 |
|
L |
68 |
20 |
6778 |
◊ |
K |
x,y,z |
1_555 |
61 |
20 |
6589 |
574.3 |
-1.5 |
0.663 |
15 |
0 |
0 |
0.000 |
16 |
|
E |
60 |
17 |
6767 |
◊ |
D |
x,y,z |
1_555 |
56 |
19 |
6534 |
542.2 |
-1.4 |
0.656 |
14 |
0 |
0 |
0.000 |
Average: |
599.9 |
-1.2 |
0.694 |
15 |
0 |
0 |
0.000 |
3 |
17 |
|
N |
50 |
18 |
6607 |
◊ |
K |
x-1/2,-y+1/2,-z+3/4 |
6_455 |
48 |
17 |
6589 |
420.9 |
-6.2 |
0.224 |
3 |
0 |
0 |
0.000 |
18 |
|
C |
49 |
20 |
6589 |
◊ |
D |
-x+1/2,y-1/2,-z+1/4 |
5_545 |
45 |
16 |
6534 |
413.1 |
-6.6 |
0.180 |
2 |
0 |
0 |
0.000 |
Average: |
417.0 |
-6.4 |
0.202 |
3 |
0 |
0 |
0.000 |
4 |
19 |
|
I |
36 |
11 |
6226 |
◊ |
G |
-y,-x,-z+1/2 |
8_555 |
36 |
12 |
6285 |
244.3 |
-2.7 |
0.563 |
6 |
0 |
0 |
0.000 |
5 |
20 |
|
J |
22 |
7 |
6556 |
◊ |
D |
x,y,z |
1_555 |
25 |
5 |
6534 |
204.6 |
1.0 |
0.818 |
2 |
0 |
0 |
0.000 |
6 |
21 |
|
L |
20 |
6 |
6778 |
◊ |
F |
x,y,z |
1_555 |
21 |
6 |
6604 |
176.6 |
-0.4 |
0.626 |
2 |
0 |
0 |
0.000 |
7 |
22 |
|
[MAN]H:201 |
10 |
1 |
300 |
f |
H |
x,y,z |
1_555 |
20 |
8 |
6673 |
146.1 |
2.9 |
0.467 |
6 |
0 |
0 |
0.100 |
23 |
|
[MAN]N:201 |
10 |
1 |
299 |
f |
N |
x,y,z |
1_555 |
20 |
8 |
6607 |
144.1 |
2.1 |
0.401 |
8 |
0 |
0 |
0.100 |
24 |
|
[MAN]L:201 |
11 |
1 |
301 |
f |
L |
x,y,z |
1_555 |
18 |
8 |
6778 |
144.0 |
2.3 |
0.387 |
5 |
0 |
0 |
0.100 |
25 |
|
[MAN]J:201 |
10 |
1 |
305 |
f |
J |
x,y,z |
1_555 |
19 |
8 |
6556 |
143.9 |
2.2 |
0.423 |
6 |
0 |
0 |
0.100 |
26 |
|
[MAN]K:201 |
10 |
1 |
304 |
f |
K |
x,y,z |
1_555 |
20 |
8 |
6589 |
143.7 |
2.3 |
0.400 |
6 |
0 |
0 |
0.100 |
27 |
|
[MAN]D:201 |
10 |
1 |
298 |
f |
D |
x,y,z |
1_555 |
19 |
8 |
6534 |
142.5 |
2.5 |
0.429 |
6 |
0 |
0 |
0.100 |
28 |
|
[MAN]B:201 |
10 |
1 |
299 |
f |
B |
x,y,z |
1_555 |
20 |
8 |
6656 |
141.2 |
2.6 |
0.403 |
6 |
0 |
0 |
0.100 |
29 |
|
[MAN]C:201 |
10 |
1 |
300 |
f |
C |
x,y,z |
1_555 |
19 |
8 |
6589 |
140.8 |
2.5 |
0.419 |
6 |
0 |
0 |
0.100 |
30 |
|
[MAN]G:201 |
10 |
1 |
301 |
f |
G |
x,y,z |
1_555 |
20 |
8 |
6285 |
140.4 |
2.8 |
0.464 |
6 |
0 |
0 |
0.100 |
31 |
|
[MAN]A:201 |
10 |
1 |
299 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
6576 |
139.9 |
2.1 |
0.379 |
7 |
0 |
0 |
0.100 |
32 |
|
[MAN]M:201 |
10 |
1 |
298 |
f |
M |
x,y,z |
1_555 |
19 |
8 |
6588 |
139.7 |
2.3 |
0.400 |
6 |
0 |
0 |
0.100 |
33 |
|
[MAN]E:201 |
10 |
1 |
297 |
f |
E |
x,y,z |
1_555 |
19 |
8 |
6767 |
139.7 |
2.3 |
0.411 |
7 |
0 |
0 |
0.100 |
Average: |
142.2 |
2.4 |
0.415 |
6 |
0 |
0 |
0.100 |
8 |
34 |
|
[MAN]F:201 |
10 |
1 |
303 |
f |
F |
x,y,z |
1_555 |
19 |
8 |
6604 |
142.8 |
2.2 |
0.418 |
8 |
0 |
0 |
0.100 |
9 |
35 |
|
[MAN]I:201 |
10 |
1 |
300 |
f |
I |
x,y,z |
1_555 |
18 |
8 |
6226 |
136.0 |
2.1 |
0.392 |
7 |
0 |
0 |
0.100 |
10 |
36 |
|
M |
21 |
9 |
6588 |
◊ |
E |
x,y,z |
1_555 |
21 |
8 |
6767 |
127.7 |
1.5 |
0.832 |
0 |
0 |
0 |
0.000 |
11 |
37 |
|
M |
17 |
6 |
6588 |
◊ |
B |
x,y,z |
1_555 |
13 |
4 |
6656 |
124.6 |
-1.0 |
0.486 |
1 |
0 |
0 |
0.000 |
38 |
|
J |
14 |
4 |
6556 |
◊ |
E |
x,y,z |
1_555 |
15 |
6 |
6767 |
116.2 |
-0.5 |
0.573 |
1 |
0 |
0 |
0.000 |
Average: |
120.4 |
-0.7 |
0.530 |
1 |
0 |
0 |
0.000 |
12 |
39 |
|
K |
12 |
5 |
6589 |
◊ |
A |
x,y,z |
1_555 |
14 |
5 |
6576 |
118.0 |
0.7 |
0.629 |
2 |
0 |
0 |
0.000 |
13 |
40 |
|
N |
16 |
6 |
6607 |
◊ |
B |
x,y,z |
1_555 |
11 |
4 |
6656 |
112.3 |
1.4 |
0.849 |
0 |
0 |
0 |
0.000 |
14 |
41 |
|
H |
15 |
4 |
6673 |
◊ |
C |
x,y,z |
1_555 |
12 |
4 |
6589 |
104.5 |
-0.4 |
0.562 |
0 |
0 |
0 |
0.000 |
15 |
42 |
|
[MAN]I:201 |
6 |
1 |
300 |
◊ |
G |
-y,-x,-z+1/2 |
8_555 |
11 |
4 |
6285 |
71.6 |
1.7 |
0.516 |
0 |
0 |
0 |
0.000 |
43 |
|
[MAN]G:201 |
6 |
1 |
301 |
◊ |
I |
-y,-x,-z+1/2 |
8_555 |
12 |
4 |
6226 |
70.4 |
1.6 |
0.527 |
1 |
0 |
0 |
0.000 |
Average: |
71.0 |
1.6 |
0.522 |
1 |
0 |
0 |
0.000 |
16 |
44 |
|
I |
6 |
3 |
6226 |
◊ |
G |
x,y,z |
1_555 |
4 |
2 |
6285 |
44.5 |
0.6 |
0.821 |
1 |
0 |
0 |
0.000 |
17 |
45 |
|
J |
4 |
2 |
6556 |
◊ |
[MAN]B:201 |
-y+1/2,x+1/2,z+1/4 |
3_555 |
3 |
1 |
299 |
38.0 |
1.3 |
0.541 |
0 |
0 |
0 |
0.000 |
46 |
|
[MAN]J:201 |
3 |
1 |
305 |
◊ |
B |
-y+1/2,x+1/2,z+1/4 |
3_555 |
2 |
2 |
6656 |
17.3 |
0.2 |
0.334 |
0 |
0 |
0 |
0.000 |
47 |
|
[MAN]H:201 |
3 |
1 |
300 |
◊ |
A |
-y+1/2,x-1/2,z+1/4 |
3_545 |
2 |
2 |
6576 |
12.9 |
0.1 |
0.275 |
0 |
0 |
0 |
0.000 |
48 |
|
H |
2 |
2 |
6673 |
◊ |
[MAN]A:201 |
-y+1/2,x-1/2,z+1/4 |
3_545 |
3 |
1 |
299 |
10.4 |
0.0 |
0.264 |
0 |
0 |
0 |
0.000 |
Average: |
19.6 |
0.4 |
0.354 |
0 |
0 |
0 |
0.000 |
18 |
49 |
|
L |
4 |
2 |
6778 |
◊ |
C |
x,y,z |
1_555 |
6 |
2 |
6589 |
36.3 |
1.6 |
0.922 |
2 |
2 |
0 |
0.000 |
19 |
50 |
|
[MAN]K:201 |
3 |
1 |
304 |
◊ |
A |
x,y,z |
1_555 |
6 |
1 |
6576 |
33.0 |
0.4 |
0.413 |
0 |
0 |
0 |
0.000 |
20 |
51 |
|
I |
2 |
1 |
6226 |
◊ |
I |
-y,-x,-z+1/2 |
8_555 |
2 |
1 |
6226 |
25.4 |
-0.8 |
0.188 |
0 |
0 |
0 |
0.000 |
21 |
52 |
|
[MAN]I:201 |
3 |
1 |
300 |
◊ |
[MAN]G:201 |
-y,-x,-z+1/2 |
8_555 |
3 |
1 |
301 |
20.3 |
1.1 |
0.318 |
0 |
0 |
0 |
0.000 |
22 |
53 |
|
[MAN]C:201 |
1 |
1 |
300 |
◊ |
D |
-x+1/2,y-1/2,-z+1/4 |
5_545 |
1 |
1 |
6534 |
7.2 |
-0.0 |
0.220 |
0 |
0 |
0 |
0.000 |
23 |
54 |
|
N |
1 |
1 |
6607 |
◊ |
[MAN]K:201 |
x-1/2,-y+1/2,-z+3/4 |
6_455 |
1 |
1 |
304 |
3.1 |
-0.0 |
0.258 |
0 |
0 |
0 |
0.000 |
55 |
|
[MAN]N:201 |
1 |
1 |
299 |
◊ |
K |
x-1/2,-y+1/2,-z+3/4 |
6_455 |
1 |
1 |
6589 |
2.6 |
-0.0 |
0.261 |
0 |
0 |
0 |
0.000 |
Average: |
2.9 |
-0.0 |
0.259 |
0 |
0 |
0 |
0.000 |
24 |
56 |
|
K |
1 |
1 |
6589 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
6604 |
2.5 |
0.1 |
0.780 |
0 |
0 |
0 |
0.000 |
25 |
57 |
|
C |
1 |
1 |
6589 |
◊ |
[MAN]D:201 |
-x+1/2,y-1/2,-z+1/4 |
5_545 |
1 |
1 |
298 |
1.3 |
-0.0 |
0.284 |
0 |
0 |
0 |
0.000 |
|