## |
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 |
|
B |
101 |
25 |
6842 |
◊ |
A |
x,y,z |
1_555 |
94 |
22 |
6889 |
956.6 |
-15.2 |
0.204 |
5 |
0 |
0 |
0.631 |
2 |
2 |
|
D |
89 |
23 |
6953 |
◊ |
C |
x,y,z |
1_555 |
80 |
22 |
6869 |
874.8 |
-14.4 |
0.175 |
4 |
1 |
0 |
0.492 |
3 |
3 |
|
C |
71 |
19 |
6869 |
◊ |
A |
x,y,z |
1_555 |
75 |
20 |
6889 |
712.9 |
-11.3 |
0.218 |
3 |
0 |
0 |
0.239 |
4 |
|
D |
62 |
16 |
6953 |
◊ |
B |
x,y,z |
1_555 |
65 |
18 |
6842 |
613.8 |
-9.9 |
0.242 |
3 |
2 |
0 |
0.239 |
Average: |
663.3 |
-10.6 |
0.230 |
3 |
1 |
0 |
0.239 |
4 |
5 |
|
D |
78 |
20 |
6953 |
◊ |
A |
x,y,z |
1_555 |
77 |
19 |
6889 |
668.8 |
-10.0 |
0.293 |
2 |
0 |
0 |
0.236 |
6 |
|
C |
69 |
18 |
6869 |
◊ |
B |
x,y,z |
1_555 |
74 |
20 |
6842 |
624.9 |
-13.0 |
0.139 |
0 |
0 |
0 |
0.236 |
Average: |
646.9 |
-11.5 |
0.216 |
1 |
0 |
0 |
0.236 |
5 |
7 |
|
C |
43 |
15 |
6869 |
◊ |
B |
-x+1,y-1/2,-z+2 |
2_647 |
58 |
17 |
6842 |
412.7 |
2.2 |
0.894 |
2 |
2 |
0 |
0.000 |
6 |
8 |
|
D |
34 |
10 |
6953 |
x |
D |
-x+1,y-1/2,-z+1 |
2_646 |
37 |
11 |
6953 |
299.2 |
-1.9 |
0.596 |
3 |
4 |
0 |
0.000 |
7 |
9 |
|
A |
27 |
9 |
6889 |
◊ |
C |
x-1,y+1,z+1 |
1_466 |
32 |
9 |
6869 |
263.4 |
-0.6 |
0.693 |
0 |
1 |
0 |
0.000 |
8 |
10 |
|
B |
26 |
9 |
6842 |
◊ |
C |
x-1,y,z+1 |
1_456 |
29 |
8 |
6869 |
228.8 |
1.0 |
0.810 |
2 |
2 |
0 |
0.000 |
9 |
11 |
|
[P33]A:1 |
19 |
1 |
538 |
f |
A |
x,y,z |
1_555 |
29 |
8 |
6889 |
202.0 |
-0.8 |
0.424 |
6 |
0 |
0 |
0.124 |
10 |
12 |
|
A |
27 |
6 |
6889 |
x |
A |
-x,y-1/2,-z+2 |
2_547 |
19 |
5 |
6889 |
180.8 |
1.2 |
0.799 |
2 |
2 |
0 |
0.000 |
11 |
13 |
|
[P33]A:1 |
14 |
1 |
538 |
◊ |
C |
x,y,z |
1_555 |
27 |
5 |
6869 |
168.2 |
1.1 |
0.586 |
1 |
0 |
0 |
0.000 |
12 |
14 |
|
[1PE]D:3 |
15 |
1 |
478 |
f |
D |
x,y,z |
1_555 |
18 |
7 |
6953 |
163.7 |
-0.4 |
0.620 |
4 |
0 |
0 |
0.065 |
13 |
15 |
|
[P6G]B:4 |
15 |
1 |
481 |
f |
B |
x,y,z |
1_555 |
24 |
6 |
6842 |
158.6 |
-2.1 |
0.235 |
0 |
0 |
0 |
0.076 |
14 |
16 |
|
[P6G]B:4 |
14 |
1 |
481 |
◊ |
D |
x,y,z |
1_555 |
31 |
6 |
6953 |
151.5 |
2.3 |
0.635 |
1 |
0 |
0 |
0.000 |
15 |
17 |
|
[PG4]C:2 |
12 |
1 |
407 |
◊ |
C |
x,y,z |
1_555 |
19 |
6 |
6869 |
150.6 |
2.7 |
0.294 |
0 |
0 |
0 |
0.000 |
16 |
18 |
|
[PG4]C:5 |
12 |
1 |
415 |
◊ |
C |
x,y,z |
1_555 |
16 |
4 |
6869 |
139.3 |
3.9 |
0.323 |
1 |
0 |
0 |
0.000 |
17 |
19 |
|
A |
13 |
4 |
6889 |
◊ |
D |
-x,y-1/2,-z+2 |
2_547 |
15 |
4 |
6953 |
138.1 |
1.9 |
0.824 |
1 |
2 |
0 |
0.000 |
18 |
20 |
|
[PG4]C:5 |
11 |
1 |
415 |
◊ |
B |
x,y,z |
1_555 |
24 |
7 |
6842 |
135.0 |
2.7 |
0.283 |
0 |
0 |
0 |
0.000 |
19 |
21 |
|
D |
16 |
4 |
6953 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
14 |
3 |
6889 |
131.9 |
0.9 |
0.742 |
2 |
3 |
0 |
0.000 |
20 |
22 |
|
[1PE]D:3 |
13 |
1 |
478 |
◊ |
B |
x,y,z |
1_555 |
21 |
5 |
6842 |
124.9 |
-1.0 |
0.605 |
0 |
0 |
0 |
0.010 |
21 |
23 |
|
B |
15 |
4 |
6842 |
x |
B |
-x+1,y-1/2,-z+2 |
2_647 |
14 |
5 |
6842 |
120.7 |
0.2 |
0.688 |
1 |
5 |
0 |
0.000 |
22 |
24 |
|
[PG4]C:2 |
7 |
1 |
407 |
◊ |
A |
x,y,z |
1_555 |
18 |
4 |
6889 |
95.0 |
1.2 |
0.326 |
1 |
0 |
0 |
0.000 |
23 |
25 |
|
[PG4]C:2 |
9 |
1 |
407 |
◊ |
[P33]A:1 |
x,y,z |
1_555 |
9 |
1 |
538 |
84.9 |
0.6 |
0.163 |
0 |
0 |
0 |
0.000 |
24 |
26 |
|
B |
12 |
5 |
6842 |
x |
B |
-x,y-1/2,-z+3 |
2_548 |
10 |
5 |
6842 |
81.6 |
0.8 |
0.775 |
1 |
0 |
0 |
0.000 |
25 |
27 |
|
B |
12 |
5 |
6842 |
◊ |
A |
-x,y-1/2,-z+3 |
2_548 |
8 |
4 |
6889 |
77.5 |
0.4 |
0.703 |
0 |
0 |
0 |
0.000 |
26 |
28 |
|
C |
11 |
5 |
6869 |
◊ |
D |
x,y-1,z |
1_545 |
11 |
5 |
6953 |
74.5 |
0.2 |
0.719 |
0 |
0 |
0 |
0.000 |
27 |
29 |
|
A |
8 |
3 |
6889 |
◊ |
D |
x-1,y+1,z+1 |
1_466 |
8 |
4 |
6953 |
73.7 |
1.5 |
0.807 |
1 |
1 |
0 |
0.000 |
28 |
30 |
|
[PGE]D:6 |
8 |
1 |
313 |
◊ |
D |
x,y,z |
1_555 |
10 |
3 |
6953 |
71.9 |
2.2 |
0.130 |
0 |
0 |
0 |
0.000 |
29 |
31 |
|
[PG4]C:5 |
5 |
1 |
415 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
6889 |
69.1 |
-1.5 |
0.166 |
0 |
0 |
0 |
0.056 |
30 |
32 |
|
C |
11 |
3 |
6869 |
f |
[PGE]D:6 |
x,y-1,z |
1_545 |
5 |
1 |
313 |
66.2 |
1.1 |
0.152 |
2 |
0 |
0 |
0.000 |
31 |
33 |
|
A |
7 |
3 |
6889 |
f |
[SM]D:2 |
x-1,y,z+1 |
1_456 |
1 |
1 |
216 |
55.3 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.080 |
32 |
34 |
|
[PGE]D:6 |
4 |
1 |
313 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
6842 |
51.9 |
1.3 |
0.307 |
0 |
0 |
0 |
0.000 |
33 |
35 |
|
[PGE]D:6 |
7 |
1 |
313 |
f |
[SM]B:1 |
x,y,z |
1_555 |
1 |
1 |
216 |
48.7 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.049 |
34 |
36 |
|
C |
5 |
2 |
6869 |
f |
[SM]B:1 |
x,y-1,z |
1_545 |
1 |
1 |
216 |
46.3 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.057 |
35 |
37 |
|
C |
7 |
2 |
6869 |
◊ |
A |
-x,y-1/2,-z+3 |
2_548 |
7 |
2 |
6889 |
45.5 |
-0.6 |
0.509 |
0 |
0 |
0 |
0.000 |
36 |
38 |
|
[1PE]D:3 |
6 |
1 |
478 |
◊ |
[P6G]B:4 |
x,y,z |
1_555 |
3 |
1 |
481 |
45.1 |
1.3 |
0.705 |
1 |
0 |
0 |
0.000 |
37 |
39 |
|
[SM]B:1 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
6842 |
41.6 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.000 |
38 |
40 |
|
[SM]A:3 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
5 |
3 |
6889 |
40.3 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.060 |
39 |
41 |
|
[1PE]D:3 |
5 |
1 |
478 |
◊ |
[SM]B:1 |
x,y,z |
1_555 |
1 |
1 |
216 |
39.8 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.000 |
40 |
42 |
|
[PG4]C:2 |
5 |
1 |
407 |
f |
[P6G]B:4 |
x,y,z |
1_555 |
4 |
1 |
481 |
38.4 |
0.9 |
0.252 |
0 |
0 |
0 |
0.000 |
41 |
43 |
|
[SM]B:1 |
1 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
6953 |
36.4 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.000 |
42 |
44 |
|
[CA]D:8 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
6 |
3 |
6953 |
32.6 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.172 |
43 |
45 |
|
C |
5 |
1 |
6869 |
◊ |
B |
-x,y-1/2,-z+3 |
2_548 |
3 |
1 |
6842 |
32.6 |
-0.1 |
0.453 |
0 |
0 |
0 |
0.000 |
44 |
46 |
|
[SM]D:2 |
1 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
6953 |
32.2 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.000 |
45 |
47 |
|
[SM]A:3 |
1 |
1 |
216 |
◊ |
D |
-x,y-1/2,-z+2 |
2_547 |
2 |
1 |
6953 |
29.6 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
46 |
48 |
|
[CA]C:4 |
1 |
1 |
85 |
◊ |
C |
x,y,z |
1_555 |
7 |
4 |
6869 |
26.9 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.170 |
49 |
|
[CA]C:4 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
3 |
2 |
6953 |
12.2 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.170 |
Average: |
19.5 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.170 |
47 |
50 |
|
A |
4 |
2 |
6889 |
◊ |
C |
x-1,y,z+1 |
1_456 |
2 |
2 |
6869 |
26.7 |
0.1 |
0.546 |
0 |
0 |
0 |
0.000 |
48 |
51 |
|
[PGE]D:6 |
3 |
1 |
313 |
◊ |
[P6G]B:4 |
x,y,z |
1_555 |
3 |
1 |
481 |
24.8 |
1.6 |
0.289 |
0 |
0 |
0 |
0.000 |
49 |
52 |
|
[PG4]C:5 |
3 |
1 |
415 |
◊ |
D |
x,y,z |
1_555 |
5 |
2 |
6953 |
24.6 |
0.0 |
0.313 |
0 |
0 |
0 |
0.000 |
50 |
53 |
|
[CA]D:5 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
5 |
2 |
6953 |
21.8 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.095 |
51 |
54 |
|
[CA]B:6 |
1 |
1 |
85 |
f |
B |
-x+1,y-1/2,-z+2 |
2_647 |
4 |
2 |
6842 |
20.8 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.118 |
52 |
55 |
|
A |
5 |
2 |
6889 |
◊ |
[SM]A:3 |
-x,y-1/2,-z+2 |
2_547 |
1 |
1 |
216 |
20.7 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.000 |
53 |
56 |
|
[CA]D:9 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
4 |
2 |
6953 |
18.2 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.083 |
54 |
57 |
|
C |
5 |
3 |
6869 |
◊ |
[1PE]D:3 |
x,y-1,z |
1_545 |
3 |
1 |
478 |
15.1 |
-0.3 |
0.569 |
0 |
0 |
0 |
0.000 |
55 |
58 |
|
B |
3 |
2 |
6842 |
◊ |
D |
x-1,y,z+1 |
1_456 |
2 |
2 |
6953 |
14.4 |
0.3 |
0.758 |
0 |
0 |
0 |
0.000 |
56 |
59 |
|
[PG4]C:2 |
2 |
1 |
407 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
6842 |
14.1 |
0.4 |
0.366 |
0 |
0 |
0 |
0.000 |
57 |
60 |
|
[P6G]B:4 |
4 |
1 |
481 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
6869 |
13.0 |
-0.5 |
0.371 |
0 |
0 |
0 |
0.005 |
58 |
61 |
|
C |
3 |
1 |
6869 |
◊ |
[CA]D:9 |
x,y-1,z |
1_545 |
1 |
1 |
85 |
10.8 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.000 |
59 |
62 |
|
[P33]A:1 |
2 |
1 |
538 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
6953 |
10.6 |
0.4 |
0.574 |
0 |
0 |
0 |
0.000 |
60 |
63 |
|
[CA]C:4 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
6889 |
9.7 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.080 |
64 |
|
[CA]C:4 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
6842 |
4.5 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.080 |
Average: |
7.1 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.080 |
61 |
65 |
|
[1PE]D:3 |
4 |
1 |
478 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
6889 |
9.4 |
-0.2 |
0.562 |
0 |
0 |
0 |
0.002 |
62 |
66 |
|
[P6G]B:4 |
1 |
1 |
481 |
◊ |
[SM]B:1 |
x,y,z |
1_555 |
1 |
1 |
216 |
9.3 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
63 |
67 |
|
[CA]B:7 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
6842 |
8.9 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.041 |
64 |
68 |
|
[PGE]D:6 |
2 |
1 |
313 |
◊ |
[CA]D:8 |
x,y,z |
1_555 |
1 |
1 |
85 |
7.9 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.000 |
65 |
69 |
|
[P33]A:1 |
2 |
1 |
538 |
◊ |
D |
x,y-1,z |
1_545 |
1 |
1 |
6953 |
7.1 |
0.2 |
0.611 |
0 |
0 |
0 |
0.000 |
66 |
70 |
|
[P6G]B:4 |
3 |
1 |
481 |
◊ |
[P33]A:1 |
x,y,z |
1_555 |
2 |
1 |
538 |
6.4 |
-0.1 |
0.405 |
0 |
0 |
0 |
0.004 |
67 |
71 |
|
[CA]D:8 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
6842 |
2.6 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.004 |
68 |
72 |
|
C |
1 |
1 |
6869 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
6953 |
2.5 |
-0.0 |
0.608 |
0 |
0 |
0 |
0.000 |
69 |
73 |
|
B |
1 |
1 |
6842 |
◊ |
[SM]B:1 |
-x+1,y-1/2,-z+2 |
2_647 |
1 |
1 |
216 |
1.4 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
70 |
74 |
|
[CA]B:7 |
1 |
1 |
85 |
◊ |
B |
-x+1,y-1/2,-z+2 |
2_647 |
1 |
1 |
6842 |
1.3 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.000 |
71 |
75 |
|
[1PE]D:3 |
1 |
1 |
478 |
◊ |
[P33]A:1 |
x,y,z |
1_555 |
1 |
1 |
538 |
0.2 |
-0.0 |
0.522 |
0 |
0 |
0 |
0.000 |
|