Analysis, comparison, visualization of contact residues & interfacial waters of antibody-antigen structures/models

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Comparison between contact residues of antibody structures 1cz8HL (blue) and 1bj1HL (pink)
Structure Overlap
RMSD
Z-score
#Contact Residues of 1cz8HL
#Contact Residues of 1bj1HL
Match Size
#Identical Residues
100.00%
0.26
29.40
26
26
26
23

Matched contact residues of antibody structures (identical residues are highlighted in red)
No.
Contact residues of 1cz8HL
Region Chothia of 1cz8HL
Contact residues of 1bj1HL
Region Chothia of 1bj1HL
1
TYR L 91
CDR-L3
TYR L 91
CDR-L3
2
SER L 92
CDR-L3
SER L 92
CDR-L3
3
THR L 93
CDR-L3
THR L 93
CDR-L3
4
VAL L 94
CDR-L3
VAL L 94
CDR-L3
5
TRP L 96
CDR-L3
TRP L 96
CDR-L3
6
THR H 30
CDR-H1
THR H 30
CDR-H1
7
HIS H 31
CDR-H1
ASN H 31
CDR-H1
8
TYR H 32
CDR-H1
TYR H 32
CDR-H1
9
GLY H 33
Framework
GLY H 33
Framework
10
TRP H 47
Framework
TRP H 47
Framework
11
TRP H 50
Framework
TRP H 50
Framework
12
ASN H 52
CDR-H2
ASN H 52
CDR-H2
13
THR H 53
CDR-H2
THR H 53
CDR-H2
14
TYR H 54
CDR-H2
TYR H 54
CDR-H2
15
THR H 55
CDR-H2
THR H 55
CDR-H2
16
THR H 59
Framework
THR H 59
Framework
17
TYR H 99
CDR-H3
TYR H 99
CDR-H3
18
PRO H 100
CDR-H3
PRO H 100
CDR-H3
19
TYR H 101
CDR-H3
HIS H 101
CDR-H3
20
TYR H 102
CDR-H3
TYR H 102
CDR-H3
21
TYR H 103
CDR-H3
TYR H 103
CDR-H3
22
GLY H 104
CDR-H3
GLY H 104
CDR-H3
23
THR H 105
CDR-H3
SER H 105
CDR-H3
24
SER H 106
CDR-H3
SER H 106
CDR-H3
25
HIS H 107
CDR-H3
HIS H 107
CDR-H3
26
TRP H 108
CDR-H3
TRP H 108
CDR-H3
Matched contact residues Superimposed structures Mismatched contact residues


Comparison between contact residues of antigen structures 1cz8W (salmon) and 1bj1W (green)
Structure Overlap
RMSD
Z-score
#Contact Residues of 1cz8W
#Contact Residues of 1bj1W
Match Size
#Identical Residues
100.00%
0.15
20.40
19
17
17
17

Matched contact residues of antigen structures
No.
Contact residues of 1cz8W
Contact residues of 1bj1W
1
TYR W 45
TYR W 45
2
LYS W 48
LYS W 48
3
GLN W 79
GLN W 79
4
ILE W 80
ILE W 80
5
MET W 81
MET W 81
6
ARG W 82
ARG W 82
7
ILE W 83
ILE W 83
8
LYS W 84
LYS W 84
9
HIS W 86
HIS W 86
10
GLN W 87
GLN W 87
11
GLY W 88
GLY W 88
12
GLN W 89
GLN W 89
13
HIS W 90
HIS W 90
14
ILE W 91
ILE W 91
15
GLY W 92
GLY W 92
16
GLU W 93
GLU W 93
17
MET W 94
MET W 94
Matched contact residues Superimposed structures Mismatched contact residues