## |
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 |
|
[PTY]A:606 |
50 |
1 |
1324 |
f |
A |
x,y,z |
1_555 |
131 |
46 |
9771 |
957.1 |
-16.3 |
0.131 |
1 |
0 |
0 |
0.183 |
2 |
|
[PTY]B:607 |
50 |
1 |
1310 |
f |
B |
x,y,z |
1_555 |
131 |
46 |
9791 |
951.5 |
-16.4 |
0.146 |
1 |
0 |
0 |
0.183 |
Average: |
954.3 |
-16.3 |
0.139 |
1 |
0 |
0 |
0.183 |
2 |
3 |
|
A |
81 |
20 |
9771 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
75 |
19 |
9791 |
763.7 |
7.0 |
0.967 |
12 |
9 |
0 |
0.000 |
3 |
4 |
|
D |
42 |
8 |
2852 |
◊ |
B |
x,y,z |
1_555 |
54 |
16 |
9791 |
470.1 |
-5.2 |
0.380 |
4 |
0 |
0 |
0.077 |
5 |
|
C |
44 |
8 |
2975 |
◊ |
A |
x,y,z |
1_555 |
57 |
16 |
9771 |
466.3 |
-5.3 |
0.396 |
4 |
0 |
0 |
0.077 |
Average: |
468.2 |
-5.2 |
0.388 |
4 |
0 |
0 |
0.077 |
4 |
6 |
|
A |
51 |
19 |
9771 |
◊ |
C |
-x,y-1/2,-z+1 |
2_546 |
46 |
14 |
2975 |
441.2 |
2.0 |
0.917 |
5 |
2 |
0 |
0.000 |
5 |
7 |
|
C |
42 |
10 |
2975 |
◊ |
D |
-x,y-1/2,-z+2 |
2_547 |
47 |
13 |
2852 |
412.9 |
-9.2 |
0.261 |
0 |
0 |
0 |
0.062 |
6 |
8 |
|
A |
42 |
15 |
9771 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
35 |
14 |
9791 |
396.5 |
-5.6 |
0.152 |
4 |
2 |
0 |
0.000 |
7 |
9 |
|
B |
32 |
10 |
9791 |
x |
B |
-x+1,y-1/2,-z+2 |
2_647 |
27 |
11 |
9791 |
192.8 |
-0.1 |
0.639 |
1 |
0 |
0 |
0.000 |
8 |
10 |
|
[NAG]A:603 |
12 |
1 |
360 |
cf |
A |
x,y,z |
1_555 |
17 |
8 |
9771 |
158.5 |
4.1 |
0.430 |
1 |
0 |
0 |
0.000 |
9 |
11 |
|
[NAG]B:601 |
12 |
1 |
362 |
cf |
B |
x,y,z |
1_555 |
19 |
7 |
9791 |
157.0 |
3.4 |
0.399 |
2 |
0 |
0 |
0.000 |
12 |
|
[NAG]A:604 |
12 |
1 |
359 |
cf |
A |
x,y,z |
1_555 |
20 |
7 |
9771 |
153.6 |
2.6 |
0.303 |
1 |
0 |
0 |
0.000 |
Average: |
155.3 |
3.0 |
0.351 |
2 |
0 |
0 |
0.000 |
10 |
13 |
|
[NAG]B:600 |
13 |
1 |
364 |
cf |
B |
x,y,z |
1_555 |
21 |
10 |
9791 |
156.9 |
4.1 |
0.435 |
4 |
0 |
0 |
0.000 |
11 |
14 |
|
A |
19 |
8 |
9771 |
◊ |
D |
x,y-1,z-1 |
1_544 |
18 |
4 |
2852 |
155.2 |
-0.7 |
0.641 |
1 |
0 |
0 |
0.000 |
12 |
15 |
|
A |
15 |
6 |
9771 |
x |
A |
-x,y-1/2,-z+1 |
2_546 |
15 |
5 |
9771 |
125.5 |
-0.1 |
0.642 |
2 |
0 |
0 |
0.000 |
13 |
16 |
|
[NDG]A:605 |
11 |
1 |
357 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
13 |
5 |
9791 |
119.4 |
4.5 |
0.343 |
1 |
0 |
0 |
0.000 |
14 |
17 |
|
B |
11 |
7 |
9791 |
◊ |
D |
-x+1,y-1/2,-z+2 |
2_647 |
16 |
4 |
2852 |
103.2 |
1.1 |
0.865 |
1 |
0 |
0 |
0.000 |
15 |
18 |
|
A |
12 |
5 |
9771 |
◊ |
[NAG]B:602 |
-x,y-1/2,-z+1 |
2_546 |
10 |
1 |
361 |
96.4 |
2.9 |
0.370 |
0 |
0 |
0 |
0.000 |
16 |
19 |
|
A |
13 |
4 |
9771 |
◊ |
[NAG]B:600 |
-x+1,y-1/2,-z+1 |
2_646 |
9 |
1 |
364 |
94.9 |
0.7 |
0.196 |
0 |
0 |
0 |
0.000 |
17 |
20 |
|
[NAG]A:603 |
9 |
1 |
360 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
10 |
4 |
9791 |
86.5 |
3.1 |
0.413 |
3 |
0 |
0 |
0.000 |
18 |
21 |
|
A |
10 |
3 |
9771 |
◊ |
B |
x-1,y-1,z-1 |
1_444 |
9 |
3 |
9791 |
64.4 |
0.1 |
0.676 |
1 |
0 |
0 |
0.000 |
19 |
22 |
|
[NAG]A:603 |
7 |
1 |
360 |
◊ |
C |
-x,y-1/2,-z+1 |
2_546 |
5 |
1 |
2975 |
59.2 |
0.6 |
0.251 |
2 |
0 |
0 |
0.000 |
20 |
23 |
|
[NDG]A:605 |
6 |
1 |
357 |
cf |
A |
x,y,z |
1_555 |
4 |
1 |
9771 |
55.8 |
1.8 |
0.355 |
0 |
0 |
0 |
0.000 |
21 |
24 |
|
[NAG]B:602 |
7 |
1 |
361 |
cf |
B |
x,y,z |
1_555 |
4 |
1 |
9791 |
55.8 |
1.3 |
0.342 |
0 |
0 |
0 |
0.000 |
22 |
25 |
|
[CA]C:43 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
5 |
4 |
2975 |
42.8 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.135 |
26 |
|
[CA]D:44 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
5 |
4 |
2852 |
42.0 |
-10.0 |
0.000 |
0 |
0 |
0 |
0.135 |
Average: |
42.4 |
-10.0 |
0.000 |
0 |
0 |
0 |
0.135 |
23 |
27 |
|
[CA]D:39 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
3 |
2 |
2852 |
42.6 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.150 |
28 |
|
[CA]C:46 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
4 |
2 |
2975 |
34.0 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.150 |
Average: |
38.3 |
-11.1 |
0.000 |
0 |
0 |
0 |
0.150 |
24 |
29 |
|
B |
9 |
3 |
9791 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
9771 |
42.1 |
0.4 |
0.748 |
1 |
0 |
0 |
0.000 |
25 |
30 |
|
[CA]D:38 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
4 |
3 |
2852 |
35.7 |
-10.6 |
0.000 |
0 |
0 |
0 |
0.143 |
31 |
|
[CA]C:45 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
3 |
3 |
2975 |
35.4 |
-10.6 |
0.000 |
0 |
0 |
0 |
0.143 |
Average: |
35.6 |
-10.6 |
0.000 |
0 |
0 |
0 |
0.143 |
26 |
32 |
|
[CA]D:41 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
7 |
5 |
2852 |
35.0 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.132 |
33 |
|
[CA]C:36 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
7 |
5 |
2975 |
34.9 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.132 |
Average: |
35.0 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.132 |
27 |
34 |
|
[PTY]A:606 |
4 |
1 |
1324 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
2975 |
28.6 |
-1.0 |
0.395 |
0 |
0 |
0 |
0.011 |
35 |
|
[PTY]B:607 |
4 |
1 |
1310 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
2852 |
27.8 |
-1.0 |
0.399 |
0 |
0 |
0 |
0.011 |
Average: |
28.2 |
-1.0 |
0.397 |
0 |
0 |
0 |
0.011 |
28 |
36 |
|
[CA]D:40 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
4 |
2 |
2852 |
28.5 |
-8.0 |
0.000 |
0 |
0 |
0 |
0.108 |
37 |
|
[CA]C:35 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
4 |
2 |
2975 |
28.3 |
-8.0 |
0.000 |
0 |
0 |
0 |
0.108 |
Average: |
28.4 |
-8.0 |
0.000 |
0 |
0 |
0 |
0.108 |
29 |
38 |
|
[CA]D:37 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
4 |
3 |
2852 |
27.4 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.107 |
39 |
|
[CA]C:34 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
3 |
2 |
2975 |
27.2 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.107 |
Average: |
27.3 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.107 |
30 |
40 |
|
[CA]D:40 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
9791 |
23.0 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.039 |
41 |
|
[CA]C:35 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
9771 |
22.8 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.039 |
Average: |
22.9 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.039 |
31 |
42 |
|
[CA]C:34 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
9771 |
19.4 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.030 |
43 |
|
[CA]D:37 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
9791 |
19.2 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.030 |
Average: |
19.3 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.030 |
32 |
44 |
|
[NAG]A:603 |
2 |
1 |
360 |
◊ |
[CA]C:46 |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
85 |
11.7 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.000 |
33 |
45 |
|
[CA]D:47 |
1 |
1 |
85 |
f |
[CA]D:38 |
x,y,z |
1_555 |
1 |
1 |
85 |
11.0 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.034 |
34 |
46 |
|
[CA]D:47 |
1 |
1 |
85 |
f |
[CA]D:41 |
x,y,z |
1_555 |
1 |
1 |
85 |
10.6 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.033 |
35 |
47 |
|
[CA]C:42 |
1 |
1 |
85 |
f |
[CA]C:36 |
x,y,z |
1_555 |
1 |
1 |
85 |
10.6 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.035 |
36 |
48 |
|
[CA]C:45 |
1 |
1 |
85 |
f |
[CA]C:42 |
x,y,z |
1_555 |
1 |
1 |
85 |
10.4 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.034 |
37 |
49 |
|
A |
2 |
1 |
9771 |
◊ |
[CA]C:46 |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
85 |
10.2 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.000 |
38 |
50 |
|
[NAG]B:602 |
1 |
1 |
361 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
2852 |
8.8 |
-0.0 |
0.294 |
0 |
0 |
0 |
0.000 |
39 |
51 |
|
[CA]D:41 |
1 |
1 |
85 |
f |
[CA]D:37 |
x,y,z |
1_555 |
1 |
1 |
85 |
7.5 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.023 |
40 |
52 |
|
[CA]C:36 |
1 |
1 |
85 |
f |
[CA]C:34 |
x,y,z |
1_555 |
1 |
1 |
85 |
7.3 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.024 |
41 |
53 |
|
[PTY]A:606 |
2 |
1 |
1324 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
3 |
1 |
9791 |
6.9 |
0.1 |
0.673 |
0 |
0 |
0 |
0.000 |
54 |
|
A |
2 |
1 |
9771 |
◊ |
[PTY]B:607 |
-x,y-1/2,-z+1 |
2_546 |
2 |
1 |
1310 |
2.4 |
0.1 |
0.662 |
0 |
0 |
0 |
0.000 |
Average: |
4.7 |
0.1 |
0.668 |
0 |
0 |
0 |
0.000 |
42 |
55 |
|
[CA]C:35 |
1 |
1 |
85 |
f |
[CA]C:34 |
x,y,z |
1_555 |
1 |
1 |
85 |
6.4 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.021 |
43 |
56 |
|
[CA]D:40 |
1 |
1 |
85 |
f |
[CA]D:37 |
x,y,z |
1_555 |
1 |
1 |
85 |
5.9 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.018 |
44 |
57 |
|
[CA]C:45 |
1 |
1 |
85 |
f |
[CA]C:43 |
x,y,z |
1_555 |
1 |
1 |
85 |
5.6 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.018 |
45 |
58 |
|
[CA]D:44 |
1 |
1 |
85 |
f |
[CA]D:38 |
x,y,z |
1_555 |
1 |
1 |
85 |
4.5 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.014 |
46 |
59 |
|
[PTY]B:607 |
1 |
1 |
1310 |
f |
[NAG]B:601 |
x,y,z |
1_555 |
1 |
1 |
362 |
3.7 |
0.1 |
0.428 |
0 |
0 |
0 |
0.000 |
60 |
|
[PTY]A:606 |
1 |
1 |
1324 |
f |
[NAG]A:604 |
x,y,z |
1_555 |
1 |
1 |
359 |
1.2 |
-0.0 |
0.307 |
0 |
0 |
0 |
0.000 |
Average: |
2.5 |
0.0 |
0.367 |
0 |
0 |
0 |
0.000 |
47 |
61 |
|
[CA]D:41 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
9791 |
2.8 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.004 |
62 |
|
[CA]C:36 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
9771 |
2.4 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.004 |
Average: |
2.6 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.004 |
48 |
63 |
|
[PTY]A:606 |
1 |
1 |
1324 |
◊ |
[NAG]B:602 |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
361 |
0.7 |
0.0 |
0.307 |
0 |
0 |
0 |
0.000 |
|