| ## |
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 |
|
D |
155 |
42 |
14421 |
◊ |
C |
x-1,y+1,z |
1_465 |
145 |
40 |
14406 |
1422.7 |
-3.9 |
0.398 |
19 |
10 |
0 |
0.129 |
2 |
|
A |
147 |
41 |
14542 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
146 |
39 |
14249 |
1382.1 |
-2.2 |
0.432 |
22 |
11 |
0 |
0.129 |
| Average: |
1402.4 |
-3.0 |
0.415 |
21 |
11 |
0 |
0.129 |
| 2 |
3 |
|
B |
76 |
25 |
14249 |
◊ |
A |
x,y,z |
1_555 |
71 |
22 |
14542 |
661.8 |
1.7 |
0.660 |
13 |
0 |
0 |
0.000 |
4 |
|
C |
70 |
23 |
14406 |
◊ |
D |
-x-1,y-1/2,-z-1 |
2_444 |
69 |
20 |
14421 |
608.2 |
-0.6 |
0.533 |
6 |
0 |
0 |
0.000 |
| Average: |
635.0 |
0.6 |
0.596 |
10 |
0 |
0 |
0.000 |
| 3 |
5 |
|
[NAP]D:401 |
47 |
1 |
877 |
f |
D |
x,y,z |
1_555 |
73 |
29 |
14421 |
582.7 |
-5.4 |
0.287 |
13 |
0 |
0 |
0.229 |
6 |
|
[NAP]C:401 |
47 |
1 |
875 |
f |
C |
x,y,z |
1_555 |
75 |
28 |
14406 |
582.5 |
-6.6 |
0.240 |
15 |
0 |
0 |
0.229 |
7 |
|
[NAP]A:401 |
47 |
1 |
867 |
f |
A |
x,y,z |
1_555 |
74 |
28 |
14542 |
578.5 |
-5.6 |
0.268 |
18 |
0 |
0 |
0.229 |
8 |
|
[NAP]B:401 |
47 |
1 |
886 |
f |
B |
x,y,z |
1_555 |
76 |
29 |
14249 |
576.5 |
-5.4 |
0.253 |
13 |
0 |
0 |
0.229 |
| Average: |
580.1 |
-5.8 |
0.262 |
15 |
0 |
0 |
0.229 |
| 4 |
9 |
|
C |
41 |
10 |
14406 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
42 |
12 |
14542 |
413.1 |
-0.1 |
0.544 |
5 |
0 |
0 |
0.000 |
10 |
|
D |
41 |
13 |
14421 |
◊ |
B |
x-1,y,z |
1_455 |
37 |
9 |
14249 |
386.8 |
1.1 |
0.668 |
5 |
0 |
0 |
0.000 |
| Average: |
400.0 |
0.5 |
0.606 |
5 |
0 |
0 |
0.000 |
| 5 |
11 |
|
[BLA]A:402 |
32 |
1 |
791 |
f |
A |
x,y,z |
1_555 |
54 |
21 |
14542 |
378.1 |
-8.3 |
0.672 |
5 |
0 |
0 |
0.100 |
12 |
|
[BLA]D:402 |
32 |
1 |
786 |
f |
D |
x,y,z |
1_555 |
54 |
22 |
14421 |
374.8 |
-8.9 |
0.613 |
4 |
0 |
0 |
0.100 |
| Average: |
376.5 |
-8.6 |
0.642 |
5 |
0 |
0 |
0.100 |
| 6 |
13 |
|
[BLA]B:403 |
30 |
1 |
797 |
f |
B |
x,y,z |
1_555 |
46 |
20 |
14249 |
339.2 |
-11.0 |
0.451 |
8 |
0 |
0 |
0.133 |
14 |
|
[BLA]C:402 |
30 |
1 |
790 |
f |
C |
x,y,z |
1_555 |
45 |
20 |
14406 |
328.7 |
-10.6 |
0.481 |
8 |
0 |
0 |
0.133 |
| Average: |
333.9 |
-10.8 |
0.466 |
8 |
0 |
0 |
0.133 |
| 7 |
15 |
|
[BLA]D:403 |
29 |
1 |
796 |
f |
D |
x,y,z |
1_555 |
38 |
15 |
14421 |
320.5 |
-8.4 |
0.702 |
5 |
0 |
0 |
0.204 |
16 |
|
[BLA]A:403 |
30 |
1 |
809 |
f |
A |
x,y,z |
1_555 |
39 |
16 |
14542 |
317.4 |
-8.4 |
0.718 |
5 |
0 |
0 |
0.204 |
17 |
|
[BLA]C:403 |
28 |
1 |
805 |
f |
C |
x,y,z |
1_555 |
43 |
17 |
14406 |
303.5 |
-9.0 |
0.630 |
5 |
0 |
0 |
0.204 |
| Average: |
313.8 |
-8.6 |
0.684 |
5 |
0 |
0 |
0.204 |
| 8 |
18 |
|
[BLA]B:402 |
22 |
1 |
819 |
f |
B |
x,y,z |
1_555 |
42 |
17 |
14249 |
298.8 |
-9.9 |
0.353 |
3 |
0 |
0 |
0.023 |
| 9 |
19 |
|
A |
30 |
13 |
14542 |
◊ |
D |
-x-1,y-1/2,-z |
2_445 |
30 |
13 |
14421 |
270.0 |
4.0 |
0.886 |
3 |
4 |
0 |
0.000 |
| 10 |
20 |
|
[BLA]B:403 |
34 |
1 |
797 |
f |
[BLA]B:402 |
x,y,z |
1_555 |
38 |
1 |
819 |
253.2 |
-7.6 |
0.999 |
3 |
0 |
0 |
0.018 |
| 11 |
21 |
|
[BLA]C:403 |
35 |
1 |
805 |
f |
[BLA]C:402 |
x,y,z |
1_555 |
34 |
1 |
790 |
244.6 |
-7.7 |
0.999 |
2 |
0 |
0 |
0.080 |
| 12 |
22 |
|
[BLA]A:403 |
33 |
1 |
809 |
f |
[BLA]A:402 |
x,y,z |
1_555 |
34 |
1 |
791 |
236.3 |
-8.6 |
0.997 |
2 |
0 |
0 |
0.085 |
23 |
|
[BLA]D:403 |
31 |
1 |
796 |
f |
[BLA]D:402 |
x,y,z |
1_555 |
35 |
1 |
786 |
235.7 |
-8.2 |
0.997 |
2 |
0 |
0 |
0.085 |
| Average: |
236.0 |
-8.4 |
0.997 |
2 |
0 |
0 |
0.085 |
| 13 |
24 |
|
A |
18 |
6 |
14542 |
x |
A |
x-1,y,z |
1_455 |
17 |
5 |
14542 |
145.9 |
0.4 |
0.625 |
2 |
2 |
0 |
0.000 |
| 14 |
25 |
|
[BLA]B:403 |
22 |
1 |
797 |
f |
[NAP]B:401 |
x,y,z |
1_555 |
16 |
1 |
886 |
126.1 |
-2.3 |
0.677 |
1 |
0 |
0 |
0.021 |
26 |
|
[BLA]C:402 |
22 |
1 |
790 |
f |
[NAP]C:401 |
x,y,z |
1_555 |
15 |
1 |
875 |
115.7 |
-1.8 |
0.719 |
1 |
0 |
0 |
0.021 |
| Average: |
120.9 |
-2.0 |
0.698 |
1 |
0 |
0 |
0.021 |
| 15 |
27 |
|
C |
15 |
3 |
14406 |
◊ |
B |
x,y,z |
1_555 |
16 |
3 |
14249 |
118.6 |
0.3 |
0.612 |
2 |
3 |
0 |
0.000 |
| 16 |
28 |
|
[BLA]D:402 |
22 |
1 |
786 |
f |
[NAP]D:401 |
x,y,z |
1_555 |
14 |
1 |
877 |
118.5 |
-1.9 |
0.676 |
0 |
0 |
0 |
0.017 |
29 |
|
[BLA]A:402 |
21 |
1 |
791 |
f |
[NAP]A:401 |
x,y,z |
1_555 |
12 |
1 |
867 |
113.7 |
-1.7 |
0.675 |
0 |
0 |
0 |
0.017 |
| Average: |
116.1 |
-1.8 |
0.676 |
0 |
0 |
0 |
0.017 |
| 17 |
30 |
|
[BLA]A:403 |
11 |
1 |
809 |
◊ |
[BLA]D:403 |
-x-1,y-1/2,-z |
2_445 |
12 |
1 |
796 |
88.1 |
-2.6 |
0.953 |
0 |
0 |
0 |
0.000 |
| 18 |
31 |
|
A |
9 |
4 |
14542 |
◊ |
B |
-x-1,y-1/2,-z |
2_445 |
10 |
3 |
14249 |
75.3 |
-0.7 |
0.380 |
0 |
0 |
0 |
0.000 |
| 19 |
32 |
|
[BLA]A:403 |
3 |
1 |
809 |
◊ |
D |
-x-1,y-1/2,-z |
2_445 |
8 |
4 |
14421 |
72.9 |
-1.5 |
0.380 |
0 |
0 |
0 |
0.000 |
33 |
|
A |
8 |
4 |
14542 |
◊ |
[BLA]D:403 |
-x-1,y-1/2,-z |
2_445 |
5 |
1 |
796 |
54.1 |
-1.3 |
0.474 |
0 |
0 |
0 |
0.000 |
| Average: |
63.5 |
-1.4 |
0.427 |
0 |
0 |
0 |
0.000 |
| 20 |
34 |
|
[NAP]B:401 |
6 |
1 |
886 |
◊ |
A |
x,y,z |
1_555 |
7 |
2 |
14542 |
61.6 |
2.1 |
0.846 |
0 |
0 |
0 |
0.000 |
35 |
|
[NAP]C:401 |
5 |
1 |
875 |
◊ |
D |
-x-1,y-1/2,-z-1 |
2_444 |
7 |
3 |
14421 |
46.0 |
1.1 |
0.773 |
0 |
0 |
0 |
0.000 |
| Average: |
53.8 |
1.6 |
0.809 |
0 |
0 |
0 |
0.000 |
| 21 |
36 |
|
C |
7 |
3 |
14406 |
◊ |
[BLA]A:402 |
-x,y-1/2,-z |
2_545 |
7 |
1 |
791 |
56.8 |
-1.5 |
0.449 |
0 |
0 |
0 |
0.000 |
37 |
|
[BLA]D:402 |
6 |
1 |
786 |
◊ |
B |
x-1,y,z |
1_455 |
7 |
3 |
14249 |
54.8 |
-1.4 |
0.454 |
0 |
0 |
0 |
0.000 |
| Average: |
55.8 |
-1.5 |
0.451 |
0 |
0 |
0 |
0.000 |
| 22 |
38 |
|
D |
4 |
2 |
14421 |
x |
D |
x-1,y,z |
1_455 |
9 |
3 |
14421 |
46.8 |
-0.9 |
0.228 |
0 |
0 |
0 |
0.000 |
| 23 |
39 |
|
C |
5 |
1 |
14406 |
◊ |
[BLA]A:403 |
-x,y-1/2,-z |
2_545 |
5 |
1 |
809 |
40.4 |
-1.0 |
0.533 |
0 |
0 |
0 |
0.000 |
40 |
|
[BLA]D:403 |
6 |
1 |
796 |
◊ |
B |
x-1,y,z |
1_455 |
5 |
1 |
14249 |
39.3 |
-0.8 |
0.593 |
0 |
0 |
0 |
0.000 |
| Average: |
39.9 |
-0.9 |
0.563 |
0 |
0 |
0 |
0.000 |
| 24 |
41 |
|
A |
5 |
3 |
14542 |
◊ |
B |
x-1,y,z |
1_455 |
5 |
2 |
14249 |
40.0 |
0.9 |
0.783 |
0 |
0 |
0 |
0.000 |
| 25 |
42 |
|
[BLA]D:403 |
1 |
1 |
796 |
f |
[NAP]D:401 |
x,y,z |
1_555 |
1 |
1 |
877 |
4.0 |
-0.0 |
0.681 |
0 |
0 |
0 |
0.000 |
43 |
|
[BLA]A:403 |
1 |
1 |
809 |
f |
[NAP]A:401 |
x,y,z |
1_555 |
1 |
1 |
867 |
1.7 |
-0.0 |
0.664 |
0 |
0 |
0 |
0.000 |
| Average: |
2.8 |
-0.0 |
0.672 |
0 |
0 |
0 |
0.000 |
| 26 |
44 |
|
[BLA]B:402 |
1 |
1 |
819 |
f |
[NAP]B:401 |
x,y,z |
1_555 |
1 |
1 |
886 |
2.0 |
-0.0 |
0.681 |
0 |
0 |
0 |
0.000 |
| 27 |
45 |
|
A |
1 |
1 |
14542 |
◊ |
[BLA]D:402 |
-x-1,y-1/2,-z |
2_445 |
1 |
1 |
786 |
1.4 |
-0.0 |
0.764 |
0 |
0 |
0 |
0.000 |
46 |
|
[BLA]A:402 |
1 |
1 |
791 |
◊ |
D |
-x-1,y-1/2,-z |
2_445 |
1 |
1 |
14421 |
1.2 |
-0.0 |
0.758 |
0 |
0 |
0 |
0.000 |
| Average: |
1.3 |
-0.0 |
0.761 |
0 |
0 |
0 |
0.000 |
|