## |
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 |
183 |
54 |
11318 |
◊ |
L |
x,y,z |
1_555 |
193 |
56 |
11231 |
1797.9 |
-22.2 |
0.080 |
14 |
1 |
0 |
0.949 |
2 |
2 |
|
B |
180 |
51 |
11139 |
◊ |
A |
x,y,z |
1_555 |
194 |
57 |
11268 |
1728.0 |
-25.8 |
0.024 |
11 |
2 |
0 |
0.701 |
3 |
3 |
|
X |
106 |
31 |
11756 |
x |
X |
x-1/2,-y-1/2,-z |
4_445 |
95 |
28 |
11756 |
925.4 |
-4.8 |
0.471 |
14 |
2 |
0 |
0.000 |
4 |
4 |
|
H |
64 |
18 |
11318 |
◊ |
Y |
x,y,z |
1_555 |
60 |
20 |
10914 |
573.7 |
-3.5 |
0.422 |
12 |
0 |
0 |
0.157 |
5 |
5 |
|
B |
65 |
19 |
11139 |
◊ |
X |
x,y,z |
1_555 |
59 |
21 |
11756 |
564.6 |
-1.6 |
0.553 |
12 |
0 |
0 |
0.207 |
6 |
6 |
|
Y |
55 |
14 |
10914 |
◊ |
X |
x,y,z |
1_555 |
58 |
14 |
11756 |
536.0 |
-6.3 |
0.200 |
3 |
0 |
0 |
0.000 |
7 |
7 |
|
H |
57 |
21 |
11318 |
◊ |
L |
x-1,y,z |
1_455 |
58 |
19 |
11231 |
532.9 |
-0.6 |
0.691 |
6 |
1 |
0 |
0.000 |
8 |
8 |
|
X |
61 |
19 |
11756 |
◊ |
H |
-x-1/2,-y,z-1/2 |
2_454 |
51 |
18 |
11318 |
496.7 |
-3.4 |
0.419 |
4 |
0 |
0 |
0.000 |
9 |
9 |
|
B |
48 |
15 |
11139 |
◊ |
Y |
-x,y-1/2,-z+1/2 |
3_545 |
53 |
13 |
10914 |
454.0 |
-3.5 |
0.429 |
4 |
0 |
0 |
0.000 |
10 |
10 |
|
A |
48 |
19 |
11268 |
◊ |
B |
x-1,y,z |
1_455 |
48 |
17 |
11139 |
420.3 |
2.5 |
0.867 |
5 |
0 |
0 |
0.000 |
11 |
11 |
|
L |
46 |
14 |
11231 |
◊ |
Y |
x,y,z |
1_555 |
45 |
13 |
10914 |
410.0 |
-4.7 |
0.242 |
3 |
0 |
0 |
0.107 |
12 |
12 |
|
A |
42 |
14 |
11268 |
◊ |
X |
x,y,z |
1_555 |
50 |
13 |
11756 |
386.3 |
-4.7 |
0.254 |
3 |
0 |
0 |
0.085 |
13 |
13 |
|
X |
35 |
10 |
11756 |
x |
X |
x-1,y,z |
1_455 |
35 |
9 |
11756 |
328.3 |
-5.3 |
0.096 |
2 |
0 |
0 |
0.000 |
14 |
|
Y |
35 |
9 |
10914 |
x |
Y |
x-1,y,z |
1_455 |
33 |
11 |
10914 |
313.9 |
-6.0 |
0.073 |
1 |
0 |
0 |
0.000 |
Average: |
321.1 |
-5.6 |
0.085 |
2 |
0 |
0 |
0.000 |
14 |
15 |
|
L |
26 |
11 |
11231 |
◊ |
A |
x-1,y,z |
1_455 |
25 |
7 |
11268 |
239.5 |
0.7 |
0.727 |
2 |
0 |
0 |
0.000 |
15 |
16 |
|
X |
21 |
7 |
11756 |
◊ |
L |
-x-1/2,-y,z-1/2 |
2_454 |
30 |
12 |
11231 |
235.3 |
-0.4 |
0.472 |
1 |
0 |
0 |
0.000 |
16 |
17 |
|
Y |
26 |
11 |
10914 |
◊ |
L |
-x-3/2,-y,z-1/2 |
2_354 |
22 |
8 |
11231 |
219.2 |
1.7 |
0.804 |
3 |
0 |
0 |
0.000 |
17 |
18 |
|
X |
27 |
8 |
11756 |
◊ |
H |
-x-3/2,-y,z-1/2 |
2_354 |
28 |
8 |
11318 |
210.2 |
-1.8 |
0.428 |
1 |
0 |
0 |
0.000 |
18 |
19 |
|
Y |
22 |
7 |
10914 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
22 |
6 |
11268 |
201.8 |
-1.2 |
0.465 |
0 |
0 |
0 |
0.000 |
19 |
20 |
|
Y |
34 |
12 |
10914 |
◊ |
L |
-x-1/2,-y,z-1/2 |
2_454 |
20 |
9 |
11231 |
195.2 |
-1.5 |
0.485 |
1 |
0 |
0 |
0.000 |
20 |
21 |
|
L |
24 |
7 |
11231 |
◊ |
A |
x,y,z |
1_555 |
23 |
7 |
11268 |
194.7 |
-0.5 |
0.586 |
1 |
0 |
0 |
0.000 |
21 |
22 |
|
B |
24 |
8 |
11139 |
◊ |
Y |
-x-1,y-1/2,-z+1/2 |
3_445 |
20 |
8 |
10914 |
192.6 |
-2.2 |
0.330 |
3 |
0 |
0 |
0.000 |
22 |
23 |
|
[NAG]X:2004 |
11 |
1 |
363 |
cf |
X |
x,y,z |
1_555 |
26 |
11 |
11756 |
167.6 |
4.4 |
0.511 |
1 |
0 |
0 |
0.000 |
23 |
24 |
|
H |
18 |
8 |
11318 |
◊ |
A |
x-1,y,z |
1_455 |
16 |
8 |
11268 |
139.7 |
-0.4 |
0.618 |
1 |
0 |
0 |
0.000 |
24 |
25 |
|
X |
9 |
3 |
11756 |
◊ |
B |
x-1,y,z |
1_455 |
18 |
4 |
11139 |
131.2 |
0.7 |
0.733 |
1 |
0 |
0 |
0.000 |
25 |
26 |
|
A |
14 |
4 |
11268 |
◊ |
Y |
-x-1,y-1/2,-z+1/2 |
3_445 |
11 |
6 |
10914 |
98.7 |
-0.3 |
0.568 |
0 |
0 |
0 |
0.000 |
26 |
27 |
|
H |
13 |
3 |
11318 |
◊ |
Y |
x-1,y,z |
1_455 |
7 |
2 |
10914 |
74.2 |
0.0 |
0.540 |
0 |
0 |
0 |
0.000 |
27 |
28 |
|
[SO4]B:222 |
5 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
11139 |
72.8 |
-9.7 |
0.854 |
4 |
0 |
0 |
0.341 |
28 |
29 |
|
[NAG]X:2005 |
8 |
1 |
358 |
cf |
[NAG]X:2004 |
x,y,z |
1_555 |
7 |
1 |
363 |
70.9 |
1.5 |
0.089 |
0 |
0 |
0 |
0.000 |
29 |
30 |
|
[NAG]X:2005 |
8 |
1 |
358 |
f |
X |
x,y,z |
1_555 |
14 |
6 |
11756 |
66.9 |
1.2 |
0.264 |
0 |
0 |
0 |
0.000 |
30 |
31 |
|
H |
12 |
5 |
11318 |
◊ |
B |
x-1,y,z |
1_455 |
7 |
4 |
11139 |
65.5 |
-0.6 |
0.554 |
1 |
0 |
0 |
0.000 |
31 |
32 |
|
X |
7 |
3 |
11756 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
12 |
3 |
11139 |
62.7 |
-1.0 |
0.292 |
0 |
0 |
0 |
0.000 |
32 |
33 |
|
[SO4]B:222 |
4 |
1 |
183 |
◊ |
X |
x,y,z |
1_555 |
8 |
4 |
11756 |
52.5 |
-6.1 |
0.814 |
3 |
0 |
0 |
0.220 |
33 |
34 |
|
[CA]Y:2001 |
1 |
1 |
85 |
f |
Y |
x,y,z |
1_555 |
10 |
5 |
10914 |
47.5 |
-11.7 |
0.000 |
0 |
0 |
0 |
0.377 |
35 |
|
[CA]X:2001 |
1 |
1 |
85 |
f |
X |
x,y,z |
1_555 |
5 |
3 |
11756 |
43.2 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.377 |
Average: |
45.4 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.377 |
34 |
36 |
|
X |
7 |
2 |
11756 |
◊ |
[SO4]B:222 |
x-1/2,-y-1/2,-z |
4_445 |
4 |
1 |
183 |
40.5 |
-5.2 |
0.513 |
0 |
0 |
0 |
0.000 |
35 |
37 |
|
X |
3 |
1 |
11756 |
◊ |
L |
-x-3/2,-y,z-1/2 |
2_354 |
5 |
2 |
11231 |
37.2 |
0.7 |
0.708 |
0 |
0 |
0 |
0.000 |
36 |
38 |
|
[NAG]X:2005 |
4 |
1 |
358 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
7 |
3 |
11139 |
32.9 |
0.6 |
0.381 |
0 |
0 |
0 |
0.000 |
37 |
39 |
|
L |
7 |
2 |
11231 |
x |
L |
x-1,y,z |
1_455 |
3 |
1 |
11231 |
28.1 |
-0.4 |
0.477 |
0 |
0 |
0 |
0.000 |
38 |
40 |
|
A |
3 |
1 |
11268 |
◊ |
H |
-x-1,y-1/2,-z+1/2 |
3_445 |
1 |
1 |
11318 |
16.2 |
-0.0 |
0.351 |
0 |
0 |
0 |
0.000 |
39 |
41 |
|
[CA]X:2002 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
11139 |
10.9 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.053 |
40 |
42 |
|
[CA]Y:2002 |
1 |
1 |
85 |
f |
H |
x,y,z |
1_555 |
1 |
1 |
11318 |
9.8 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.100 |
|