## |
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 |
118 |
14 |
4103 |
◊ |
B |
x,y,z |
1_555 |
122 |
42 |
41385 |
1059.8 |
-10.7 |
0.629 |
16 |
0 |
0 |
0.528 |
2 |
|
N |
125 |
14 |
4088 |
◊ |
D |
x,y,z |
1_555 |
120 |
41 |
41636 |
1009.9 |
-10.2 |
0.579 |
14 |
0 |
0 |
0.528 |
3 |
|
E |
123 |
13 |
4124 |
◊ |
A |
x,y,z |
1_555 |
124 |
42 |
41471 |
987.1 |
-8.3 |
0.574 |
10 |
0 |
0 |
0.528 |
4 |
|
K |
123 |
13 |
4046 |
◊ |
C |
x,y,z |
1_555 |
118 |
43 |
41356 |
967.3 |
-9.0 |
0.461 |
8 |
0 |
0 |
0.528 |
Average: |
1006.0 |
-9.6 |
0.561 |
12 |
0 |
0 |
0.528 |
2 |
5 |
|
B |
96 |
23 |
41385 |
◊ |
A |
x,y-1,z |
1_545 |
100 |
27 |
41471 |
886.1 |
-9.7 |
0.185 |
6 |
2 |
0 |
0.000 |
6 |
|
D |
86 |
24 |
41636 |
◊ |
C |
x,y,z-1 |
1_554 |
94 |
24 |
41356 |
860.0 |
-11.1 |
0.120 |
6 |
1 |
0 |
0.000 |
Average: |
873.1 |
-10.4 |
0.152 |
6 |
2 |
0 |
0.000 |
3 |
7 |
|
F |
75 |
8 |
1963 |
◊ |
A |
x,y,z |
1_555 |
71 |
24 |
41471 |
649.2 |
-9.2 |
0.748 |
8 |
0 |
0 |
0.356 |
8 |
|
L |
72 |
8 |
1953 |
◊ |
C |
x,y,z |
1_555 |
72 |
24 |
41356 |
639.9 |
-5.9 |
0.838 |
8 |
0 |
0 |
0.356 |
9 |
|
O |
71 |
8 |
1937 |
◊ |
D |
x,y,z |
1_555 |
81 |
25 |
41636 |
638.3 |
-7.7 |
0.760 |
7 |
0 |
0 |
0.356 |
10 |
|
I |
69 |
8 |
1915 |
◊ |
B |
x,y,z |
1_555 |
79 |
28 |
41385 |
624.7 |
-7.7 |
0.738 |
7 |
0 |
0 |
0.356 |
Average: |
638.0 |
-7.6 |
0.771 |
8 |
0 |
0 |
0.356 |
4 |
11 |
|
F |
44 |
8 |
1963 |
◊ |
E |
x,y,z |
1_555 |
45 |
8 |
4124 |
397.3 |
-4.5 |
0.730 |
20 |
0 |
0 |
1.000 |
12 |
|
I |
44 |
8 |
1915 |
◊ |
H |
x,y,z |
1_555 |
46 |
8 |
4103 |
386.0 |
-4.8 |
0.717 |
21 |
0 |
0 |
1.000 |
13 |
|
L |
42 |
8 |
1953 |
◊ |
K |
x,y,z |
1_555 |
47 |
8 |
4046 |
384.7 |
-4.1 |
0.748 |
22 |
0 |
0 |
1.000 |
14 |
|
O |
44 |
8 |
1937 |
◊ |
N |
x,y,z |
1_555 |
46 |
8 |
4088 |
382.0 |
-4.3 |
0.742 |
21 |
0 |
0 |
1.000 |
Average: |
387.5 |
-4.4 |
0.734 |
21 |
0 |
0 |
1.000 |
5 |
15 |
|
B |
43 |
17 |
41385 |
x |
B |
x-1,y,z |
1_455 |
49 |
17 |
41385 |
384.2 |
-2.1 |
0.527 |
4 |
2 |
0 |
0.000 |
6 |
16 |
|
G |
37 |
9 |
2160 |
◊ |
E |
x,y,z |
1_555 |
41 |
8 |
4124 |
381.4 |
-6.9 |
0.486 |
17 |
0 |
0 |
1.000 |
17 |
|
P |
40 |
9 |
2149 |
◊ |
N |
x,y,z |
1_555 |
40 |
8 |
4088 |
380.8 |
-5.9 |
0.536 |
17 |
0 |
0 |
1.000 |
18 |
|
M |
37 |
9 |
2146 |
◊ |
K |
x,y,z |
1_555 |
41 |
8 |
4046 |
370.9 |
-6.1 |
0.533 |
18 |
0 |
0 |
1.000 |
19 |
|
J |
37 |
9 |
2148 |
◊ |
H |
x,y,z |
1_555 |
39 |
8 |
4103 |
367.7 |
-6.3 |
0.535 |
19 |
0 |
0 |
1.000 |
Average: |
375.2 |
-6.3 |
0.522 |
18 |
0 |
0 |
1.000 |
7 |
20 |
|
C |
41 |
11 |
41356 |
x |
C |
x-1,y-1,z |
1_445 |
44 |
14 |
41356 |
338.5 |
-0.9 |
0.617 |
1 |
3 |
0 |
0.000 |
8 |
21 |
|
D |
46 |
18 |
41636 |
x |
D |
x-1,y,z |
1_455 |
35 |
10 |
41636 |
325.4 |
0.9 |
0.761 |
2 |
0 |
0 |
0.000 |
9 |
22 |
|
D |
39 |
15 |
41636 |
◊ |
A |
x,y,z |
1_555 |
41 |
16 |
41471 |
295.0 |
-0.9 |
0.582 |
1 |
1 |
0 |
0.000 |
10 |
23 |
|
C |
34 |
11 |
41356 |
◊ |
B |
x,y,z |
1_555 |
34 |
13 |
41385 |
278.9 |
-2.4 |
0.340 |
2 |
1 |
0 |
0.000 |
11 |
24 |
|
[APC]B:2001 |
27 |
1 |
641 |
f |
B |
x,y,z |
1_555 |
29 |
10 |
41385 |
276.4 |
1.7 |
0.743 |
3 |
0 |
0 |
0.012 |
25 |
|
[APC]C:2002 |
23 |
1 |
637 |
f |
C |
x,y,z |
1_555 |
28 |
11 |
41356 |
268.1 |
2.3 |
0.805 |
6 |
0 |
0 |
0.012 |
Average: |
272.3 |
2.0 |
0.774 |
5 |
0 |
0 |
0.012 |
12 |
26 |
|
C |
40 |
13 |
41356 |
x |
C |
x-1,y,z |
1_455 |
27 |
7 |
41356 |
275.2 |
0.1 |
0.560 |
1 |
0 |
0 |
0.000 |
13 |
27 |
|
P |
35 |
8 |
2149 |
◊ |
D |
x,y,z |
1_555 |
28 |
12 |
41636 |
256.5 |
1.9 |
0.846 |
3 |
0 |
0 |
0.033 |
28 |
|
G |
36 |
8 |
2160 |
◊ |
A |
x,y,z |
1_555 |
25 |
12 |
41471 |
218.4 |
0.9 |
0.819 |
3 |
0 |
0 |
0.033 |
29 |
|
J |
25 |
6 |
2148 |
◊ |
B |
x,y,z |
1_555 |
22 |
9 |
41385 |
194.3 |
-1.2 |
0.631 |
1 |
0 |
0 |
0.033 |
30 |
|
M |
27 |
5 |
2146 |
◊ |
C |
x,y,z |
1_555 |
21 |
9 |
41356 |
183.5 |
0.9 |
0.808 |
1 |
0 |
0 |
0.033 |
Average: |
213.2 |
0.6 |
0.776 |
2 |
0 |
0 |
0.033 |
14 |
31 |
|
[APC]D:2003 |
24 |
1 |
620 |
f |
D |
x,y,z |
1_555 |
26 |
11 |
41636 |
255.6 |
2.9 |
0.832 |
10 |
0 |
0 |
0.047 |
15 |
32 |
|
[APC]A:2000 |
25 |
1 |
627 |
f |
A |
x,y,z |
1_555 |
26 |
12 |
41471 |
253.9 |
1.3 |
0.756 |
6 |
0 |
0 |
0.043 |
16 |
33 |
|
B |
22 |
9 |
41385 |
◊ |
A |
x,y,z |
1_555 |
22 |
9 |
41471 |
195.0 |
-0.5 |
0.578 |
0 |
1 |
0 |
0.000 |
17 |
34 |
|
B |
18 |
5 |
41385 |
x |
B |
x,y-1,z |
1_545 |
25 |
10 |
41385 |
182.3 |
-3.2 |
0.163 |
1 |
0 |
0 |
0.000 |
18 |
35 |
|
[APC]C:2002 |
9 |
1 |
637 |
◊ |
L |
x,y,z |
1_555 |
13 |
2 |
1953 |
91.2 |
-3.1 |
0.461 |
1 |
0 |
0 |
0.109 |
36 |
|
[APC]B:2001 |
6 |
1 |
641 |
◊ |
I |
x,y,z |
1_555 |
12 |
1 |
1915 |
61.8 |
-2.0 |
0.427 |
0 |
0 |
0 |
0.109 |
Average: |
76.5 |
-2.5 |
0.444 |
1 |
0 |
0 |
0.109 |
19 |
37 |
|
[APC]B:2001 |
6 |
1 |
641 |
◊ |
H |
x,y,z |
1_555 |
9 |
2 |
4103 |
81.2 |
0.7 |
0.640 |
1 |
0 |
0 |
0.006 |
38 |
|
[APC]D:2003 |
5 |
1 |
620 |
◊ |
N |
x,y,z |
1_555 |
6 |
2 |
4088 |
67.5 |
0.7 |
0.602 |
2 |
0 |
0 |
0.006 |
39 |
|
[APC]A:2000 |
6 |
1 |
627 |
◊ |
E |
x,y,z |
1_555 |
7 |
2 |
4124 |
67.4 |
0.8 |
0.651 |
2 |
0 |
0 |
0.006 |
40 |
|
[APC]C:2002 |
5 |
1 |
637 |
◊ |
K |
x,y,z |
1_555 |
6 |
2 |
4046 |
61.8 |
1.3 |
0.688 |
0 |
0 |
0 |
0.006 |
Average: |
69.5 |
0.9 |
0.645 |
1 |
0 |
0 |
0.006 |
20 |
41 |
|
C |
8 |
4 |
41356 |
x |
C |
x,y-1,z |
1_545 |
10 |
4 |
41356 |
79.2 |
1.0 |
0.759 |
0 |
1 |
0 |
0.000 |
21 |
42 |
|
[APC]A:2000 |
8 |
1 |
627 |
◊ |
F |
x,y,z |
1_555 |
13 |
2 |
1963 |
72.5 |
-3.0 |
0.445 |
1 |
0 |
0 |
0.094 |
22 |
43 |
|
D |
8 |
4 |
41636 |
◊ |
A |
x-1,y-1,z |
1_445 |
11 |
3 |
41471 |
66.1 |
-0.9 |
0.384 |
0 |
0 |
0 |
0.000 |
23 |
44 |
|
[APC]D:2003 |
8 |
1 |
620 |
◊ |
O |
x,y,z |
1_555 |
11 |
1 |
1937 |
59.6 |
-2.0 |
0.488 |
1 |
0 |
0 |
0.074 |
24 |
45 |
|
A |
4 |
2 |
41471 |
◊ |
E |
x-1,y,z |
1_455 |
9 |
3 |
4124 |
54.9 |
0.2 |
0.655 |
1 |
0 |
0 |
0.000 |
25 |
46 |
|
A |
12 |
5 |
41471 |
◊ |
B |
x-1,y,z |
1_455 |
6 |
3 |
41385 |
52.7 |
0.2 |
0.625 |
0 |
0 |
0 |
0.000 |
26 |
47 |
|
[APC]C:2002 |
5 |
1 |
637 |
f |
[MG]C:3003 |
x,y,z |
1_555 |
1 |
1 |
98 |
44.7 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.243 |
48 |
|
[APC]A:2000 |
4 |
1 |
627 |
f |
[MG]A:3001 |
x,y,z |
1_555 |
1 |
1 |
98 |
43.8 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.243 |
49 |
|
[APC]D:2003 |
4 |
1 |
620 |
f |
[MG]D:3004 |
x,y,z |
1_555 |
1 |
1 |
98 |
42.4 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.243 |
50 |
|
[APC]B:2001 |
5 |
1 |
641 |
f |
[MG]B:3002 |
x,y,z |
1_555 |
1 |
1 |
98 |
40.6 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.243 |
Average: |
42.9 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.243 |
27 |
51 |
|
A |
9 |
3 |
41471 |
◊ |
G |
x-1,y,z |
1_455 |
3 |
1 |
2160 |
43.6 |
-0.7 |
0.440 |
0 |
0 |
0 |
0.000 |
28 |
52 |
|
C |
5 |
2 |
41356 |
◊ |
J |
x-1,y,z |
1_455 |
4 |
1 |
2148 |
41.8 |
-0.1 |
0.605 |
1 |
0 |
0 |
0.000 |
29 |
53 |
|
[MG]C:3007 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
5 |
2 |
41356 |
35.5 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.135 |
54 |
|
[MG]F:3005 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
41471 |
33.1 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.135 |
55 |
|
[MG]B:3006 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
41385 |
30.3 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.135 |
56 |
|
[MG]D:3008 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
7 |
2 |
41636 |
29.0 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.135 |
Average: |
32.0 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.135 |
30 |
57 |
|
[MG]B:3002 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
41385 |
35.1 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.108 |
58 |
|
[MG]D:3004 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
6 |
3 |
41636 |
28.4 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.108 |
59 |
|
[MG]C:3003 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
7 |
4 |
41356 |
27.3 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.108 |
60 |
|
[MG]A:3001 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
5 |
2 |
41471 |
26.1 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.108 |
Average: |
29.2 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.108 |
31 |
61 |
|
K |
6 |
2 |
4046 |
◊ |
B |
x-1,y,z |
1_455 |
4 |
1 |
41385 |
34.1 |
-0.2 |
0.505 |
0 |
0 |
0 |
0.000 |
32 |
62 |
|
B |
5 |
3 |
41385 |
◊ |
C |
x,y-1,z |
1_545 |
5 |
3 |
41356 |
34.0 |
0.2 |
0.671 |
0 |
0 |
0 |
0.000 |
33 |
63 |
|
[APC]C:2002 |
5 |
1 |
637 |
f |
[MG]C:3007 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.3 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.125 |
64 |
|
[APC]B:2001 |
5 |
1 |
641 |
f |
[MG]B:3006 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.3 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.125 |
65 |
|
[APC]D:2003 |
4 |
1 |
620 |
f |
[MG]D:3008 |
x,y,z |
1_555 |
1 |
1 |
98 |
28.7 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.125 |
66 |
|
[APC]A:2000 |
4 |
1 |
627 |
f |
[MG]F:3005 |
x,y,z |
1_555 |
1 |
1 |
98 |
27.2 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.125 |
Average: |
29.1 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.125 |
34 |
67 |
|
C |
5 |
2 |
41356 |
◊ |
B |
x-1,y,z |
1_455 |
4 |
2 |
41385 |
29.4 |
0.3 |
0.732 |
0 |
0 |
0 |
0.000 |
35 |
68 |
|
[MG]F:3005 |
1 |
1 |
98 |
◊ |
F |
x,y,z |
1_555 |
8 |
1 |
1963 |
28.4 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.087 |
69 |
|
[MG]D:3008 |
1 |
1 |
98 |
◊ |
O |
x,y,z |
1_555 |
8 |
1 |
1937 |
27.4 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.087 |
70 |
|
[MG]B:3006 |
1 |
1 |
98 |
◊ |
I |
x,y,z |
1_555 |
8 |
1 |
1915 |
26.6 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.087 |
71 |
|
[MG]C:3007 |
1 |
1 |
98 |
◊ |
L |
x,y,z |
1_555 |
7 |
1 |
1953 |
23.2 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.087 |
Average: |
26.4 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.087 |
36 |
72 |
|
[MG]F:3005 |
1 |
1 |
98 |
◊ |
E |
x,y,z |
1_555 |
4 |
1 |
4124 |
12.7 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.029 |
73 |
|
[MG]D:3008 |
1 |
1 |
98 |
◊ |
N |
x,y,z |
1_555 |
3 |
1 |
4088 |
12.3 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.029 |
74 |
|
[MG]B:3006 |
1 |
1 |
98 |
◊ |
H |
x,y,z |
1_555 |
3 |
1 |
4103 |
9.6 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.029 |
75 |
|
[MG]C:3007 |
1 |
1 |
98 |
◊ |
K |
x,y,z |
1_555 |
3 |
1 |
4046 |
4.1 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.029 |
Average: |
9.7 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.029 |
37 |
76 |
|
N |
1 |
1 |
4088 |
◊ |
D |
x-1,y,z |
1_455 |
2 |
1 |
41636 |
7.2 |
-0.5 |
0.262 |
0 |
0 |
0 |
0.000 |
38 |
77 |
|
B |
2 |
2 |
41385 |
◊ |
A |
x-1,y-1,z |
1_445 |
2 |
2 |
41471 |
6.8 |
-0.0 |
0.606 |
0 |
0 |
0 |
0.000 |
39 |
78 |
|
D |
1 |
1 |
41636 |
x |
D |
x,y-1,z |
1_545 |
2 |
1 |
41636 |
3.5 |
-0.1 |
0.452 |
0 |
0 |
0 |
0.000 |
|