## |
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 |
|
F |
186 |
49 |
15682 |
◊ |
E |
x,y,z |
1_555 |
186 |
46 |
15533 |
1934.0 |
-28.2 |
0.010 |
15 |
8 |
0 |
0.565 |
2 |
|
C |
191 |
49 |
15812 |
◊ |
A |
x,y,z |
1_555 |
188 |
48 |
15356 |
1925.8 |
-28.4 |
0.011 |
12 |
8 |
0 |
0.565 |
3 |
|
D |
187 |
49 |
15837 |
◊ |
B |
x,y,z |
1_555 |
183 |
49 |
15456 |
1920.7 |
-28.4 |
0.011 |
11 |
8 |
0 |
0.565 |
4 |
|
H |
183 |
48 |
15427 |
◊ |
G |
x,y,z |
1_555 |
181 |
48 |
15646 |
1886.3 |
-28.1 |
0.010 |
11 |
8 |
0 |
0.565 |
Average: |
1916.7 |
-28.3 |
0.011 |
12 |
8 |
0 |
0.565 |
2 |
5 |
|
G |
55 |
16 |
15646 |
◊ |
H |
-x-1,y-1/2,-z-1/2 |
3_444 |
62 |
16 |
15427 |
560.3 |
-5.2 |
0.312 |
6 |
4 |
0 |
0.000 |
6 |
|
B |
59 |
19 |
15456 |
◊ |
D |
x-1/2,-y-1/2,-z-1 |
4_444 |
59 |
17 |
15837 |
543.2 |
-4.6 |
0.370 |
6 |
5 |
0 |
0.000 |
Average: |
551.8 |
-4.9 |
0.341 |
6 |
5 |
0 |
0.000 |
3 |
7 |
|
G |
64 |
16 |
15646 |
◊ |
C |
x,y,z |
1_555 |
63 |
18 |
15812 |
485.8 |
-6.5 |
0.247 |
1 |
0 |
0 |
0.000 |
8 |
|
F |
65 |
18 |
15682 |
◊ |
D |
x,y,z |
1_555 |
62 |
17 |
15837 |
472.1 |
-6.5 |
0.259 |
2 |
0 |
0 |
0.000 |
Average: |
478.9 |
-6.5 |
0.253 |
2 |
0 |
0 |
0.000 |
4 |
9 |
|
G |
59 |
16 |
15646 |
◊ |
C |
-x,y-1/2,-z-1/2 |
3_544 |
48 |
12 |
15812 |
476.1 |
-1.9 |
0.562 |
6 |
5 |
0 |
0.039 |
10 |
|
F |
42 |
10 |
15682 |
◊ |
D |
x-1/2,-y+1/2,-z-1 |
4_454 |
47 |
14 |
15837 |
412.2 |
-2.5 |
0.480 |
4 |
4 |
0 |
0.039 |
Average: |
444.1 |
-2.2 |
0.521 |
5 |
5 |
0 |
0.039 |
5 |
11 |
|
E |
51 |
18 |
15533 |
◊ |
C |
-x-1/2,-y,z-1/2 |
2_454 |
47 |
18 |
15812 |
470.0 |
0.8 |
0.751 |
9 |
0 |
0 |
0.000 |
12 |
|
F |
52 |
20 |
15682 |
◊ |
A |
x,y,z |
1_555 |
48 |
15 |
15356 |
463.6 |
3.1 |
0.865 |
7 |
0 |
0 |
0.000 |
Average: |
466.8 |
1.9 |
0.808 |
8 |
0 |
0 |
0.000 |
6 |
13 |
|
D |
40 |
14 |
15837 |
◊ |
H |
-x-1/2,-y,z-1/2 |
2_454 |
43 |
14 |
15427 |
407.5 |
-0.0 |
0.666 |
3 |
0 |
0 |
0.000 |
14 |
|
G |
36 |
13 |
15646 |
◊ |
B |
x,y,z |
1_555 |
42 |
14 |
15456 |
383.7 |
2.3 |
0.837 |
6 |
0 |
0 |
0.000 |
Average: |
395.6 |
1.1 |
0.751 |
5 |
0 |
0 |
0.000 |
7 |
15 |
|
[ADP]D:1401 |
27 |
1 |
549 |
f |
D |
x,y,z |
1_555 |
58 |
22 |
15837 |
405.7 |
-4.6 |
0.649 |
12 |
0 |
0 |
0.332 |
16 |
|
[ADP]G:1401 |
27 |
1 |
550 |
f |
G |
x,y,z |
1_555 |
59 |
21 |
15646 |
405.2 |
-4.4 |
0.654 |
13 |
0 |
0 |
0.332 |
17 |
|
[ADP]E:1401 |
26 |
1 |
547 |
f |
E |
x,y,z |
1_555 |
61 |
21 |
15533 |
404.5 |
-4.9 |
0.638 |
11 |
0 |
0 |
0.332 |
18 |
|
[ADP]B:1401 |
26 |
1 |
553 |
f |
B |
x,y,z |
1_555 |
59 |
22 |
15456 |
400.5 |
-4.3 |
0.689 |
12 |
0 |
0 |
0.332 |
19 |
|
[ADP]C:1401 |
26 |
1 |
550 |
f |
C |
x,y,z |
1_555 |
56 |
22 |
15812 |
399.9 |
-4.4 |
0.663 |
13 |
0 |
0 |
0.332 |
20 |
|
[ADP]A:1401 |
26 |
1 |
547 |
f |
A |
x,y,z |
1_555 |
58 |
22 |
15356 |
397.3 |
-4.4 |
0.672 |
11 |
0 |
0 |
0.332 |
21 |
|
[ADP]H:1401 |
26 |
1 |
547 |
f |
H |
x,y,z |
1_555 |
57 |
21 |
15427 |
396.2 |
-4.6 |
0.654 |
12 |
0 |
0 |
0.332 |
22 |
|
[ADP]F:1401 |
25 |
1 |
549 |
f |
F |
x,y,z |
1_555 |
59 |
22 |
15682 |
393.8 |
-4.1 |
0.688 |
13 |
0 |
0 |
0.332 |
Average: |
400.4 |
-4.5 |
0.663 |
12 |
0 |
0 |
0.332 |
8 |
23 |
|
[PN4]C:1402 |
19 |
1 |
531 |
f |
C |
x,y,z |
1_555 |
55 |
21 |
15812 |
391.1 |
-5.3 |
0.460 |
5 |
0 |
0 |
0.205 |
24 |
|
[PN4]F:1402 |
19 |
1 |
533 |
f |
F |
x,y,z |
1_555 |
55 |
22 |
15682 |
390.5 |
-5.2 |
0.486 |
5 |
0 |
0 |
0.205 |
25 |
|
[PN4]D:1402 |
19 |
1 |
531 |
f |
D |
x,y,z |
1_555 |
55 |
23 |
15837 |
380.9 |
-5.3 |
0.464 |
5 |
0 |
0 |
0.205 |
26 |
|
[PN4]A:1402 |
19 |
1 |
523 |
f |
A |
x,y,z |
1_555 |
52 |
21 |
15356 |
379.6 |
-4.3 |
0.529 |
5 |
0 |
0 |
0.205 |
27 |
|
[PN4]B:1402 |
19 |
1 |
524 |
f |
B |
x,y,z |
1_555 |
52 |
22 |
15456 |
376.9 |
-4.3 |
0.557 |
5 |
0 |
0 |
0.205 |
Average: |
383.8 |
-4.9 |
0.499 |
5 |
0 |
0 |
0.205 |
9 |
28 |
|
[PN4]G:1402 |
19 |
1 |
526 |
f |
G |
x,y,z |
1_555 |
49 |
22 |
15646 |
380.9 |
-3.8 |
0.576 |
5 |
0 |
0 |
0.100 |
10 |
29 |
|
E |
42 |
13 |
15533 |
◊ |
F |
x-1/2,-y+1/2,-z-1 |
4_454 |
46 |
13 |
15682 |
374.1 |
-2.2 |
0.481 |
4 |
4 |
0 |
0.000 |
30 |
|
C |
31 |
12 |
15812 |
◊ |
A |
-x,y-1/2,-z-1/2 |
3_544 |
28 |
10 |
15356 |
266.5 |
-1.9 |
0.424 |
2 |
4 |
0 |
0.000 |
Average: |
320.3 |
-2.1 |
0.453 |
3 |
4 |
0 |
0.000 |
11 |
31 |
|
[PN4]E:1402 |
19 |
1 |
507 |
f |
E |
x,y,z |
1_555 |
56 |
22 |
15533 |
369.3 |
-5.5 |
0.454 |
6 |
0 |
0 |
0.114 |
12 |
32 |
|
H |
37 |
11 |
15427 |
◊ |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
34 |
10 |
15356 |
296.5 |
-2.5 |
0.411 |
3 |
1 |
0 |
0.000 |
13 |
33 |
|
H |
27 |
9 |
15427 |
◊ |
A |
x,y,z |
1_555 |
26 |
8 |
15356 |
280.9 |
1.0 |
0.761 |
2 |
4 |
0 |
0.000 |
34 |
|
E |
24 |
9 |
15533 |
◊ |
B |
x,y,z |
1_555 |
25 |
8 |
15456 |
259.8 |
1.7 |
0.817 |
3 |
4 |
0 |
0.000 |
Average: |
270.4 |
1.3 |
0.789 |
3 |
4 |
0 |
0.000 |
14 |
35 |
|
E |
22 |
6 |
15533 |
◊ |
B |
x-1/2,-y-1/2,-z-1 |
4_444 |
18 |
6 |
15456 |
166.0 |
-0.9 |
0.484 |
1 |
2 |
0 |
0.000 |
15 |
36 |
|
G |
10 |
4 |
15646 |
◊ |
A |
x,y,z |
1_555 |
13 |
4 |
15356 |
116.1 |
0.7 |
0.757 |
1 |
0 |
0 |
0.000 |
37 |
|
F |
11 |
3 |
15682 |
◊ |
B |
x,y,z |
1_555 |
13 |
4 |
15456 |
111.5 |
0.1 |
0.626 |
0 |
0 |
0 |
0.000 |
38 |
|
H |
12 |
4 |
15427 |
◊ |
C |
x,y,z |
1_555 |
9 |
3 |
15812 |
91.8 |
0.2 |
0.672 |
0 |
0 |
0 |
0.000 |
39 |
|
E |
11 |
3 |
15533 |
◊ |
D |
x,y,z |
1_555 |
8 |
3 |
15837 |
90.4 |
0.3 |
0.688 |
0 |
0 |
0 |
0.000 |
Average: |
102.4 |
0.3 |
0.686 |
0 |
0 |
0 |
0.000 |
16 |
40 |
|
E |
10 |
3 |
15533 |
◊ |
D |
x-1,y,z |
1_455 |
9 |
2 |
15837 |
103.4 |
1.4 |
0.852 |
0 |
0 |
0 |
0.000 |
41 |
|
H |
1 |
1 |
15427 |
◊ |
C |
x-1,y,z |
1_455 |
1 |
1 |
15812 |
2.0 |
-0.0 |
0.573 |
0 |
0 |
0 |
0.000 |
Average: |
52.7 |
0.7 |
0.712 |
0 |
0 |
0 |
0.000 |
17 |
42 |
|
G |
11 |
3 |
15646 |
◊ |
D |
x,y,z |
1_555 |
10 |
4 |
15837 |
93.7 |
-1.2 |
0.358 |
0 |
0 |
0 |
0.000 |
43 |
|
D |
11 |
3 |
15837 |
◊ |
G |
-x-1/2,-y,z-1/2 |
2_454 |
11 |
4 |
15646 |
78.5 |
-0.4 |
0.559 |
1 |
0 |
0 |
0.000 |
Average: |
86.1 |
-0.8 |
0.459 |
1 |
0 |
0 |
0.000 |
18 |
44 |
|
E |
11 |
5 |
15533 |
◊ |
A |
x-1/2,-y+1/2,-z-1 |
4_454 |
11 |
4 |
15356 |
89.8 |
1.7 |
0.860 |
2 |
3 |
0 |
0.000 |
19 |
45 |
|
F |
7 |
4 |
15682 |
◊ |
C |
-x-1/2,-y,z-1/2 |
2_454 |
5 |
2 |
15812 |
66.2 |
1.3 |
0.768 |
3 |
0 |
0 |
0.000 |
46 |
|
F |
6 |
2 |
15682 |
◊ |
C |
x,y,z |
1_555 |
8 |
4 |
15812 |
65.3 |
1.3 |
0.773 |
2 |
0 |
0 |
0.000 |
Average: |
65.7 |
1.3 |
0.770 |
3 |
0 |
0 |
0.000 |
20 |
47 |
|
[PN4]G:1402 |
2 |
1 |
526 |
◊ |
H |
-x-1,y-1/2,-z-1/2 |
3_444 |
7 |
4 |
15427 |
48.9 |
-1.0 |
0.387 |
0 |
0 |
0 |
0.000 |
21 |
48 |
|
B |
5 |
2 |
15456 |
◊ |
[PN4]D:1402 |
x-1/2,-y-1/2,-z-1 |
4_444 |
4 |
1 |
531 |
48.3 |
-1.1 |
0.420 |
0 |
0 |
0 |
0.000 |
22 |
49 |
|
G |
2 |
1 |
15646 |
◊ |
[PN4]C:1402 |
-x,y-1/2,-z-1/2 |
3_544 |
4 |
1 |
531 |
28.0 |
-0.9 |
0.280 |
0 |
0 |
0 |
0.007 |
50 |
|
[PN4]F:1402 |
2 |
1 |
533 |
◊ |
D |
x-1/2,-y+1/2,-z-1 |
4_454 |
1 |
1 |
15837 |
23.9 |
-0.8 |
0.196 |
0 |
0 |
0 |
0.007 |
Average: |
26.0 |
-0.8 |
0.238 |
0 |
0 |
0 |
0.007 |
23 |
51 |
|
G |
1 |
1 |
15646 |
◊ |
A |
x,y-1,z |
1_545 |
5 |
1 |
15356 |
24.4 |
0.9 |
0.753 |
0 |
0 |
0 |
0.000 |
24 |
52 |
|
F |
2 |
2 |
15682 |
◊ |
G |
-x-1/2,-y,z-1/2 |
2_454 |
2 |
2 |
15646 |
20.9 |
0.6 |
0.747 |
0 |
0 |
0 |
0.000 |
25 |
53 |
|
C |
1 |
1 |
15812 |
◊ |
[PN4]A:1402 |
-x,y-1/2,-z-1/2 |
3_544 |
1 |
1 |
523 |
10.1 |
-0.3 |
0.337 |
0 |
0 |
0 |
0.000 |
26 |
54 |
|
[PN4]C:1402 |
2 |
1 |
531 |
f |
[ADP]C:1401 |
x,y,z |
1_555 |
1 |
1 |
550 |
7.5 |
-0.3 |
0.445 |
0 |
0 |
0 |
0.007 |
55 |
|
[PN4]G:1402 |
2 |
1 |
526 |
f |
[ADP]G:1401 |
x,y,z |
1_555 |
1 |
1 |
550 |
5.8 |
-0.2 |
0.439 |
0 |
0 |
0 |
0.007 |
56 |
|
[PN4]F:1402 |
1 |
1 |
533 |
f |
[ADP]F:1401 |
x,y,z |
1_555 |
1 |
1 |
549 |
5.0 |
-0.2 |
0.468 |
0 |
0 |
0 |
0.007 |
57 |
|
[PN4]D:1402 |
2 |
1 |
531 |
f |
[ADP]D:1401 |
x,y,z |
1_555 |
1 |
1 |
549 |
4.4 |
-0.2 |
0.469 |
0 |
0 |
0 |
0.007 |
58 |
|
[PN4]A:1402 |
1 |
1 |
523 |
f |
[ADP]A:1401 |
x,y,z |
1_555 |
1 |
1 |
547 |
3.9 |
-0.2 |
0.468 |
0 |
0 |
0 |
0.007 |
59 |
|
[PN4]B:1402 |
1 |
1 |
524 |
f |
[ADP]B:1401 |
x,y,z |
1_555 |
1 |
1 |
553 |
3.9 |
-0.2 |
0.487 |
0 |
0 |
0 |
0.007 |
Average: |
5.1 |
-0.2 |
0.463 |
0 |
0 |
0 |
0.007 |
27 |
60 |
|
[PN4]E:1402 |
1 |
1 |
507 |
f |
[ADP]E:1401 |
x,y,z |
1_555 |
1 |
1 |
547 |
1.4 |
-0.0 |
0.468 |
0 |
0 |
0 |
0.000 |
|