| ## |
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 |
193 |
47 |
12706 |
◊ |
C |
x,y,z |
1_555 |
192 |
45 |
12401 |
1728.8 |
-13.7 |
0.112 |
28 |
18 |
0 |
0.669 |
2 |
|
H |
195 |
47 |
12442 |
◊ |
G |
x,y,z |
1_555 |
193 |
45 |
12363 |
1726.8 |
-14.0 |
0.113 |
28 |
19 |
0 |
0.669 |
3 |
|
B |
194 |
45 |
12407 |
◊ |
A |
x,y,z |
1_555 |
193 |
46 |
12607 |
1719.6 |
-14.5 |
0.105 |
28 |
18 |
0 |
0.669 |
4 |
|
F |
189 |
44 |
12371 |
◊ |
E |
x,y,z |
1_555 |
193 |
45 |
12475 |
1701.3 |
-14.2 |
0.100 |
27 |
19 |
0 |
0.669 |
| Average: |
1719.1 |
-14.1 |
0.107 |
28 |
19 |
0 |
0.669 |
| 2 |
5 |
|
C |
148 |
40 |
12401 |
◊ |
B |
x,y,z |
1_555 |
148 |
41 |
12407 |
1383.2 |
-12.0 |
0.106 |
22 |
10 |
0 |
0.617 |
6 |
|
G |
149 |
41 |
12363 |
◊ |
F |
x,y,z |
1_555 |
151 |
41 |
12371 |
1382.5 |
-11.2 |
0.126 |
23 |
11 |
0 |
0.617 |
7 |
|
H |
142 |
40 |
12442 |
◊ |
E |
x,y,z |
1_555 |
147 |
40 |
12475 |
1342.3 |
-12.3 |
0.092 |
23 |
11 |
0 |
0.617 |
8 |
|
D |
143 |
39 |
12706 |
◊ |
A |
x,y,z |
1_555 |
139 |
41 |
12607 |
1332.7 |
-11.3 |
0.119 |
23 |
9 |
0 |
0.617 |
| Average: |
1360.2 |
-11.7 |
0.111 |
23 |
10 |
0 |
0.617 |
| 3 |
9 |
|
E |
105 |
26 |
12475 |
◊ |
A |
x,y,z |
1_555 |
110 |
31 |
12607 |
1061.9 |
-2.2 |
0.524 |
16 |
7 |
0 |
0.151 |
10 |
|
B |
98 |
27 |
12407 |
◊ |
G |
x,y,z-1 |
1_554 |
99 |
28 |
12363 |
994.7 |
-3.7 |
0.406 |
9 |
10 |
0 |
0.151 |
11 |
|
F |
100 |
26 |
12371 |
◊ |
C |
x,y-1,z |
1_545 |
103 |
28 |
12401 |
968.5 |
-5.6 |
0.278 |
11 |
10 |
0 |
0.151 |
| Average: |
1008.4 |
-3.8 |
0.403 |
12 |
9 |
0 |
0.151 |
| 4 |
12 |
|
D |
67 |
15 |
12706 |
◊ |
B |
x,y,z |
1_555 |
72 |
21 |
12407 |
671.4 |
-1.2 |
0.488 |
10 |
1 |
0 |
0.084 |
13 |
|
H |
56 |
13 |
12442 |
◊ |
F |
x,y,z |
1_555 |
54 |
13 |
12371 |
543.1 |
-1.6 |
0.433 |
7 |
1 |
0 |
0.084 |
14 |
|
C |
53 |
13 |
12401 |
◊ |
A |
x,y,z |
1_555 |
54 |
13 |
12607 |
539.7 |
-2.2 |
0.414 |
9 |
2 |
0 |
0.084 |
15 |
|
G |
56 |
14 |
12363 |
◊ |
E |
x,y,z |
1_555 |
53 |
13 |
12475 |
527.6 |
-1.2 |
0.516 |
9 |
2 |
0 |
0.084 |
| Average: |
570.5 |
-1.6 |
0.463 |
9 |
2 |
0 |
0.084 |
| 5 |
16 |
|
[NAP]D:1257 |
46 |
1 |
883 |
f |
D |
x,y,z |
1_555 |
89 |
36 |
12706 |
602.5 |
-3.9 |
0.432 |
22 |
0 |
0 |
0.707 |
17 |
|
[NAP]H:1257 |
48 |
1 |
878 |
f |
H |
x,y,z |
1_555 |
84 |
33 |
12442 |
598.4 |
-3.9 |
0.425 |
21 |
0 |
0 |
0.707 |
18 |
|
[NAP]E:1258 |
47 |
1 |
883 |
f |
E |
x,y,z |
1_555 |
95 |
34 |
12475 |
597.0 |
-4.1 |
0.445 |
20 |
0 |
0 |
0.707 |
19 |
|
[NAP]A:1257 |
48 |
1 |
881 |
f |
A |
x,y,z |
1_555 |
90 |
34 |
12607 |
593.8 |
-4.5 |
0.409 |
20 |
0 |
0 |
0.707 |
20 |
|
[NAP]F:1257 |
47 |
1 |
879 |
f |
F |
x,y,z |
1_555 |
90 |
37 |
12371 |
593.7 |
-3.7 |
0.445 |
21 |
0 |
0 |
0.707 |
21 |
|
[NAP]C:1257 |
47 |
1 |
881 |
f |
C |
x,y,z |
1_555 |
92 |
35 |
12401 |
590.5 |
-4.2 |
0.433 |
18 |
0 |
0 |
0.707 |
22 |
|
[NAP]B:1257 |
47 |
1 |
875 |
f |
B |
x,y,z |
1_555 |
95 |
37 |
12407 |
589.0 |
-3.7 |
0.478 |
23 |
0 |
0 |
0.707 |
23 |
|
[NAP]G:1257 |
47 |
1 |
878 |
f |
G |
x,y,z |
1_555 |
93 |
36 |
12363 |
587.7 |
-4.3 |
0.447 |
21 |
0 |
0 |
0.707 |
| Average: |
594.1 |
-4.1 |
0.439 |
21 |
0 |
0 |
0.707 |
| 6 |
24 |
|
D |
32 |
11 |
12706 |
◊ |
H |
x-1,y,z-1 |
1_454 |
28 |
11 |
12442 |
281.1 |
6.1 |
0.949 |
6 |
6 |
0 |
0.000 |
| 7 |
25 |
|
[FPL]F:1258 |
14 |
1 |
374 |
f |
F |
x,y,z |
1_555 |
41 |
17 |
12371 |
229.0 |
5.4 |
0.284 |
1 |
0 |
0 |
0.000 |
26 |
|
[FPL]B:1258 |
14 |
1 |
370 |
f |
B |
x,y,z |
1_555 |
46 |
17 |
12407 |
228.0 |
5.3 |
0.296 |
1 |
0 |
0 |
0.000 |
27 |
|
[FPL]G:1258 |
14 |
1 |
369 |
f |
G |
x,y,z |
1_555 |
43 |
16 |
12363 |
226.3 |
5.6 |
0.335 |
1 |
0 |
0 |
0.000 |
28 |
|
[FPL]E:1259 |
15 |
1 |
371 |
f |
E |
x,y,z |
1_555 |
41 |
16 |
12475 |
225.9 |
5.3 |
0.236 |
1 |
0 |
0 |
0.000 |
29 |
|
[FPL]D:1258 |
14 |
1 |
370 |
f |
D |
x,y,z |
1_555 |
40 |
16 |
12706 |
222.9 |
5.4 |
0.302 |
1 |
0 |
0 |
0.000 |
30 |
|
[FPL]C:1258 |
14 |
1 |
372 |
f |
C |
x,y,z |
1_555 |
40 |
16 |
12401 |
222.7 |
5.4 |
0.280 |
1 |
0 |
0 |
0.000 |
31 |
|
[FPL]H:1258 |
14 |
1 |
367 |
f |
H |
x,y,z |
1_555 |
40 |
16 |
12442 |
218.0 |
5.4 |
0.287 |
1 |
0 |
0 |
0.000 |
32 |
|
[FPL]A:1258 |
15 |
1 |
370 |
f |
A |
x,y,z |
1_555 |
40 |
16 |
12607 |
217.7 |
5.6 |
0.263 |
1 |
0 |
0 |
0.000 |
| Average: |
223.8 |
5.4 |
0.286 |
1 |
0 |
0 |
0.000 |
| 8 |
33 |
|
F |
28 |
13 |
12371 |
◊ |
A |
x,y,z |
1_555 |
19 |
5 |
12607 |
220.2 |
3.2 |
0.860 |
2 |
1 |
0 |
0.000 |
34 |
|
E |
12 |
5 |
12475 |
◊ |
B |
x,y,z |
1_555 |
15 |
7 |
12407 |
106.9 |
0.9 |
0.735 |
2 |
2 |
0 |
0.000 |
35 |
|
F |
9 |
4 |
12371 |
◊ |
D |
x,y-1,z |
1_545 |
13 |
6 |
12706 |
84.5 |
0.3 |
0.648 |
0 |
0 |
0 |
0.000 |
36 |
|
E |
12 |
7 |
12475 |
◊ |
C |
x,y-1,z |
1_545 |
8 |
5 |
12401 |
79.1 |
1.0 |
0.712 |
0 |
1 |
0 |
0.000 |
37 |
|
A |
9 |
6 |
12607 |
◊ |
G |
x,y,z-1 |
1_554 |
12 |
5 |
12363 |
75.5 |
0.5 |
0.634 |
0 |
0 |
0 |
0.000 |
38 |
|
B |
7 |
4 |
12407 |
◊ |
H |
x,y,z-1 |
1_554 |
12 |
6 |
12442 |
67.3 |
-0.2 |
0.546 |
0 |
0 |
0 |
0.000 |
| Average: |
105.6 |
1.0 |
0.689 |
1 |
1 |
0 |
0.000 |
| 9 |
39 |
|
D |
14 |
5 |
12706 |
◊ |
B |
x-1,y,z |
1_455 |
18 |
7 |
12407 |
122.9 |
2.7 |
0.861 |
2 |
2 |
0 |
0.000 |
| 10 |
40 |
|
G |
11 |
3 |
12363 |
◊ |
C |
x,y-1,z+1 |
1_546 |
12 |
3 |
12401 |
112.9 |
1.4 |
0.806 |
2 |
2 |
0 |
0.000 |
| 11 |
41 |
|
[FPL]D:1258 |
11 |
1 |
370 |
f |
[NAP]D:1257 |
x,y,z |
1_555 |
16 |
1 |
883 |
94.7 |
1.2 |
0.050 |
1 |
0 |
0 |
0.000 |
42 |
|
[FPL]F:1258 |
11 |
1 |
374 |
f |
[NAP]F:1257 |
x,y,z |
1_555 |
16 |
1 |
879 |
94.3 |
1.4 |
0.050 |
1 |
0 |
0 |
0.000 |
43 |
|
[FPL]B:1258 |
11 |
1 |
370 |
f |
[NAP]B:1257 |
x,y,z |
1_555 |
16 |
1 |
875 |
93.5 |
1.3 |
0.054 |
1 |
0 |
0 |
0.000 |
44 |
|
[FPL]H:1258 |
10 |
1 |
367 |
f |
[NAP]H:1257 |
x,y,z |
1_555 |
16 |
1 |
878 |
93.4 |
1.1 |
0.062 |
1 |
0 |
0 |
0.000 |
45 |
|
[FPL]C:1258 |
11 |
1 |
372 |
f |
[NAP]C:1257 |
x,y,z |
1_555 |
17 |
1 |
881 |
92.6 |
1.4 |
0.058 |
1 |
0 |
0 |
0.000 |
46 |
|
[FPL]A:1258 |
10 |
1 |
370 |
f |
[NAP]A:1257 |
x,y,z |
1_555 |
16 |
1 |
881 |
92.3 |
1.1 |
0.070 |
1 |
0 |
0 |
0.000 |
47 |
|
[FPL]E:1259 |
10 |
1 |
371 |
f |
[NAP]E:1258 |
x,y,z |
1_555 |
16 |
1 |
883 |
91.2 |
0.9 |
0.065 |
1 |
0 |
0 |
0.000 |
48 |
|
[FPL]G:1258 |
11 |
1 |
369 |
f |
[NAP]G:1257 |
x,y,z |
1_555 |
16 |
1 |
878 |
90.9 |
1.2 |
0.058 |
1 |
0 |
0 |
0.000 |
| Average: |
92.9 |
1.2 |
0.058 |
1 |
0 |
0 |
0.000 |
| 12 |
49 |
|
[CL]E:1257 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
8 |
6 |
12475 |
44.0 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.104 |
| 13 |
50 |
|
D |
3 |
1 |
12706 |
◊ |
G |
x,y,z-1 |
1_554 |
4 |
1 |
12363 |
37.5 |
1.3 |
0.867 |
1 |
0 |
0 |
0.000 |
| 14 |
51 |
|
A |
4 |
1 |
12607 |
◊ |
C |
x,y-1,z |
1_545 |
4 |
2 |
12401 |
37.0 |
-0.1 |
0.370 |
0 |
0 |
0 |
0.000 |
| 15 |
52 |
|
B |
3 |
1 |
12407 |
◊ |
[NAP]G:1257 |
x,y,z-1 |
1_554 |
4 |
1 |
878 |
30.5 |
0.6 |
0.738 |
0 |
0 |
0 |
0.000 |
53 |
|
F |
3 |
1 |
12371 |
◊ |
[NAP]C:1257 |
x,y-1,z |
1_545 |
4 |
1 |
881 |
29.3 |
0.6 |
0.723 |
0 |
0 |
0 |
0.000 |
54 |
|
[NAP]B:1257 |
3 |
1 |
875 |
◊ |
G |
x,y,z-1 |
1_554 |
2 |
1 |
12363 |
19.9 |
0.5 |
0.738 |
0 |
0 |
0 |
0.000 |
55 |
|
[NAP]F:1257 |
3 |
1 |
879 |
◊ |
C |
x,y-1,z |
1_545 |
3 |
1 |
12401 |
19.0 |
0.5 |
0.696 |
0 |
0 |
0 |
0.000 |
56 |
|
[NAP]E:1258 |
2 |
1 |
883 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
12607 |
18.4 |
0.5 |
0.734 |
0 |
0 |
0 |
0.000 |
57 |
|
[NAP]A:1257 |
1 |
1 |
881 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
12475 |
17.5 |
0.5 |
0.816 |
0 |
0 |
0 |
0.000 |
| Average: |
22.4 |
0.5 |
0.741 |
0 |
0 |
0 |
0.000 |
| 16 |
58 |
|
[CL]E:1257 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
12607 |
26.5 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.011 |
| 17 |
59 |
|
D |
2 |
1 |
12706 |
◊ |
E |
x-1,y,z |
1_455 |
1 |
1 |
12475 |
10.2 |
0.4 |
0.831 |
0 |
0 |
0 |
0.000 |
|