2F6A

collagen adhesin and collagen complex structure

• Total interactions analyzed: 45
• Total true interactions: 26
• Strongest Interaction:
  • Chains: F-G
  • Int. Res.: 44
  • Norm. En. per Res.: -3.9557
• Hub Node: A(7)

All Interactions

Chains	Hydro. Bond Ener. (kJ/mol)	Elec. Ener. (kJ/mol)	VDW. Ener. (kJ/mol)	Tot. Stab. Ener. (kJ/mol)	#int. res.	# Short cont.	#Hydr. int.	#VDW pairs	#salt bridges	#Pot. fav. elec. int	#Pot. unfav. elec. int
A-B	-17.9527	-6.3525	-79.8475	-104.1527	51	9	1	4046	0	11	8
A-C	0.0	0.0	-0.3697	-0.3697	2	0	0	56	0	1	0
A-D	-22.89	0.0	-121.464	-144.354	71	9	1	5802	0	8	15
A-E	0.0	3.4083	-62.6269	-59.2186	42	2	0	2589	0	6	4
A-F	-2.3873	-6.4308	-14.0349	-22.853	38	2	0	955	0	3	5
A-G	0.0	-7.0393	-44.7774	-51.8167	43	4	0	1889	0	4	2
A-I	0.0	0.0	-1.2422	-1.2422	8	0	0	228	0	2	3
B-D	0.0	0.0	-0.0013	-0.0013	2	0	0	3	0	0	0
B-H	-3.6099	0.0	-59.4132	-63.0231	35	1	0	2152	0	0	0
B-I	0.0	0.0	-15.1165	-15.1165	40	1	0	944	0	1	0
B-J	0.0	0.0	-28.4681	-28.4681	41	0	0	1212	0	1	0
C-D	-9.8074	-7.7414	-98.2978	-115.8466	55	2	0	4414	0	11	8
C-E	0.0	0.0	-53.7352	-53.7352	34	0	0	2058	0	0	0
C-F	0.0	0.0	-18.6179	-18.6179	45	1	0	992	0	1	0
C-G	0.0	0.0	-45.1503	-45.1503	46	2	0	1998	0	1	0
D-E	0.0	0.0	-2.329	-2.329	2	0	0	89	0	0	1
D-F	0.0	0.0	-1.0815	-1.0815	6	0	0	186	0	2	3
D-H	0.0	0.0	-57.5407	-57.5407	45	3	0	2362	0	3	3
D-I	0.0	-8.6936	-20.0687	-28.7623	39	1	0	1084	0	3	7
D-J	0.0	-4.599	-33.6318	-38.2308	41	0	0	1476	0	3	2
E-F	-18.8173	18.2011	-165.626	-166.2422	44	5	0	4703	0	0	4
E-G	-42.8698	26.9504	-126.556	-142.4755	44	4	0	3992	0	0	4
F-G	-34.1095	19.0889	-159.031	-174.0517	44	6	0	4630	0	0	4
H-I	-24.1297	13.9026	-131.967	-142.1941	44	4	0	4133	0	0	4
H-J	-40.3049	14.8699	-118.693	-144.128	43	4	0	3908	0	0	4
I-J	-6.7128	1.124	-125.479	-131.0678	43	2	0	3814	0	0	4

Interface residues

• A-B: ALA239A, ALA246B, ASN232B, ASN256A, ASN259A, ASN273B, ASP218A, ASP242A, ASP242B, ASP255A, ASP262A, GLN216A, GLN237A, GLN267B, GLU197B, GLU244A, GLY228B, GLY236A, GLY268B, HIS230B, ILE240A, ILE252A, ILE261A, LEU217A, LEU219A, LEU222A, LYS198B, LYS245B, LYS251A, LYS258A, PHE243B, PHE247B, PRO248B, SER199B, SER220A, SER231B, SER238A, SER271B, THR227B, THR229B, THR241A, THR253A, THR257A, THR260A, TYR200B, TYR233B, TYR234B, TYR269B, TYR272B, VAL226B, VAL254A
• A-C: GLN237C, LYS47A
• A-D: ALA297A, ALA297D, ASN259D, ASN285A, ASN285D, ASN293A, ASN293D, ASN294A, ASN294D, ASN308A, ASN308D, ASN313A, ASN313D, ASN318D, GLN210A, GLN210D, GLN212A, GLN212D, GLN215A, GLN215D, GLN216A, GLN216D, GLN287A, GLN287D, GLN288A, GLN288D, GLN296A, GLN296D, GLU286A, GLU286D, GLU290A, GLU290D, GLY213A, GLY213D, GLY214A, GLY214D, GLY309A, GLY309D, GLY98A, GLY98D, HIS314A, HIS314D, HIS317A, HIS317D, ILE211A, ILE211D, ILE283D, LYS208A, LYS208D, LYS282D, LYS289A, LYS289D, LYS310A, LYS310D, LYS97D, PHE291A, PHE291D, PHE312A, PHE312D, SER295A, SER295D, SER311A, SER311D, THR284A, THR284D, THR315A, THR315D, TRP298A, TRP298D, VAL292A, VAL292D
• A-E: ARG136A, ARG15E, ARG17E, ARG189A, ASN193A, ASN196A, ASN223A, ASN225A, ASN278A, ASN313A, ASP179A, GLU183A, GLU197A, GLY10E, GLY13E, GLY168A, GLY16E, GLY178A, GLY7E, HIS314A, ILE277A, LEU181A, LEU192A, LYS176A, LYS280A, MET180A, PHE173A, PHE191A, PHE312A, PRO11E, PRO14E, PRO8E, SER170A, SER171A, SER276A, THR169A, THR177A, TRP190A, TYR174A, TYR175A, TYR233A, VAL172A
• A-F: ALA167A, ARG136A, ARG15F, ARG17F, ARG189A, ASN137A, ASN225A, ASN313A, ASP179A, ASP50A, GLN134A, GLU49A, GLY10F, GLY135A, GLY13F, GLY168A, GLY178A, GLY4F, GLY51A, GLY52A, GLY7F, HIS314A, LEU138A, LEU181A, LYS164A, LYS310A, LYS84A, MET180A, PHE312A, PRO11F, PRO14F, PRO8F, SER165A, SER311A, THR177A, TYR175A, TYR233A, TYR88A
• A-G: ALA167A, ARG136A, ARG15G, ARG17G, ARG189A, ASN193A, ASN223A, ASN225A, ASN232A, ASN278A, ASP50A, GLU166A, GLU49A, GLY10G, GLY13G, GLY168A, GLY4G, GLY7G, HIS163A, ILE224A, LEU181A, LYS164A, LYS198A, PHE191A, PRO11G, PRO14G, PRO2G, PRO5G, PRO8G, SER144A, SER165A, SER170A, SER235A, SER274A, SER276A, THR169A, THR177A, THR227A, TYR175A, TYR233A, TYR234A, VAL172A, VAL226A
• A-I: ARG17I, ASP262A, GLN210A, GLN296A, LYS208A, LYS258A, THR18I, THR260A
• B-D: GLN237B, LYS47D
• B-H: ARG136B, ARG189B, ASN193B, ASN196B, ASN223B, ASN225B, ASN278B, ASP179B, GLU183B, GLU197B, GLY168B, GLY178B, GLY22H, GLY25H, GLY28H, HIS314B, ILE277B, LEU181B, LEU192B, LYS176B, LYS280B, PHE173B, PHE191B, PRO23H, PRO26H, PRO29H, SER170B, SER171B, SER276B, THR177B, TRP190B, TYR174B, TYR175B, TYR233B, VAL172B
• B-I: ALA167B, ARG136B, ARG15I, ARG189B, ASN225B, ASN232B, ASP179B, ASP50B, GLN134B, GLN237B, GLU49B, GLY135B, GLY168B, GLY178B, GLY19I, GLY22I, GLY25I, GLY28I, GLY51B, GLY52B, HIS314B, LEU138B, LEU181B, LYS164B, LYS176B, LYS84B, PHE191B, PRO23I, PRO26I, PRO29I, SER165B, SER235B, THR177B, THR18I, THR315B, TYR175B, TYR233B, TYR234B, TYR88B, VAL316B
• B-J: ALA167B, ARG136B, ARG17J, ARG189B, ASN193B, ASN223B, ASN225B, ASN232B, ASN278B, ASP50B, GLN140B, GLN237B, GLU166B, GLU49B, GLY168B, GLY19J, GLY22J, GLY236B, GLY25J, GLY28J, ILE224B, LEU138B, LYS164B, LYS280B, PHE191B, PRO20J, PRO23J, PRO26J, SER165B, SER170B, SER235B, SER276B, THR169B, THR177B, THR18J, THR227B, TYR175B, TYR233B, TYR234B, VAL172B, VAL226B
• C-D: ALA239D, ALA246C, ASN195C, ASN232C, ASN256D, ASN273C, ASP218D, ASP242C, ASP242D, ASP255D, ASP262D, GLN237D, GLN267C, GLU197C, GLU244D, GLY228C, GLY236D, GLY268C, GLY270C, HIS230C, ILE240D, ILE252D, ILE261D, LEU217D, LEU219D, LEU222D, LYS198C, LYS245C, LYS245D, LYS251D, LYS258D, PHE243C, PHE243D, PHE247C, PRO248C, SER199C, SER220D, SER231C, SER238D, SER271C, SER274C, THR227C, THR229C, THR241D, THR253D, THR257D, THR260D, TYR200C, TYR233C, TYR234C, TYR269C, TYR272C, VAL201C, VAL226C, VAL254D
• C-E: ARG136C, ARG189C, ASN193C, ASN196C, ASN223C, ASN278C, ASP179C, ASP184C, GLU183C, GLU197C, GLY168C, GLY178C, GLY22E, GLY25E, GLY28E, HIS314C, LEU181C, LEU192C, LYS176C, LYS280C, PHE173C, PHE191C, PRO23E, PRO26E, PRO29E, SER170C, SER171C, SER276C, THR177C, TRP190C, TYR174C, TYR175C, TYR233C, VAL172C
• C-F: ALA167C, ARG136C, ARG15F, ARG189C, ASN137C, ASN225C, ASP179C, ASP50C, GLN134C, GLN237C, GLU166C, GLU49C, GLY135C, GLY168C, GLY178C, GLY19F, GLY22F, GLY236C, GLY25F, GLY28F, GLY51C, GLY52C, HIS314C, HIS317C, LEU138C, LEU181C, LYS164C, LYS176C, LYS84C, MET180C, PRO23F, PRO26F, PRO29F, SER165C, SER170C, SER235C, SER238C, THR177C, THR18F, THR315C, TYR175C, TYR233C, TYR234C, TYR88C, VAL172C
• C-G: ALA167C, ALA239C, ARG136C, ARG17G, ARG189C, ASN193C, ASN223C, ASN225C, ASN232C, ASN278C, ASP242C, ASP50C, GLN237C, GLU166C, GLU49C, GLY168C, GLY19G, GLY22G, GLY236C, GLY25G, GLY28G, HIS163C, ILE224C, LYS164C, LYS280C, PHE191C, PRO20G, PRO23G, PRO26G, PRO29G, SER144C, SER165C, SER170C, SER235C, SER238C, SER276C, THR169C, THR177C, THR18G, THR221C, THR227C, TYR175C, TYR233C, TYR234C, VAL172C, VAL226C
• D-E: ARG15E, LYS258D
• D-F: ARG17F, GLN210D, LYS208D, LYS258D, THR18F, THR260D
• D-H: ARG136D, ARG15H, ARG17H, ARG189D, ASN193D, ASN196D, ASN223D, ASN225D, ASN278D, ASN313D, ASP179D, GLU183D, GLY10H, GLY13H, GLY168D, GLY16H, GLY178D, GLY7H, HIS314D, ILE277D, LEU181D, LEU192D, LYS176D, LYS280D, LYS304D, LYS310D, PHE173D, PHE191D, PHE312D, PRO11H, PRO14H, PRO8H, SER170D, SER171D, SER276D, SER311D, THR169D, THR177D, THR18H, THR315D, TRP190D, TYR174D, TYR175D, TYR233D, VAL172D
• D-I: ARG136D, ARG15I, ARG17I, ARG189D, ASN137D, ASN225D, ASN313D, ASP179D, ASP50D, GLN134D, GLU49D, GLY10I, GLY135D, GLY13I, GLY4I, GLY51D, GLY52D, GLY7I, HIS163D, HIS314D, ILE48D, LEU138D, LEU181D, LYS164D, LYS176D, LYS310D, LYS47D, LYS53D, LYS84D, PHE312D, PRO11I, PRO14I, PRO8I, SER165D, SER311D, THR177D, TYR175D, TYR233D, TYR88D
• D-J: ALA167D, ARG136D, ARG15J, ARG189D, ASN193D, ASN223D, ASN225D, ASN232D, ASN278D, ASP50D, GLU166D, GLU49D, GLY10J, GLY13J, GLY168D, GLY236D, GLY4J, GLY7J, HIS163D, ILE224D, LYS164D, PHE191D, PRO11J, PRO14J, PRO2J, PRO5J, PRO8J, SER165D, SER170D, SER171D, SER235D, SER274D, SER276D, THR169D, THR177D, THR227D, TYR175D, TYR233D, TYR234D, VAL172D, VAL226D
• E-F: ARG15E, ARG15F, ARG17E, ARG17F, GLY10E, GLY10F, GLY13E, GLY13F, GLY16E, GLY16F, GLY19E, GLY19F, GLY1E, GLY1F, GLY22E, GLY22F, GLY25E, GLY25F, GLY28E, GLY28F, GLY4E, GLY4F, GLY7E, GLY7F, PRO11E, PRO11F, PRO14E, PRO14F, PRO20E, PRO20F, PRO23E, PRO23F, PRO26E, PRO26F, PRO29E, PRO29F, PRO2E, PRO2F, PRO5E, PRO5F, PRO8E, PRO8F, THR18E, THR18F
• E-G: ARG15E, ARG15G, ARG17E, ARG17G, GLY10E, GLY10G, GLY13E, GLY13G, GLY16E, GLY16G, GLY19E, GLY19G, GLY1E, GLY1G, GLY22E, GLY22G, GLY25E, GLY25G, GLY28E, GLY28G, GLY4E, GLY4G, GLY7E, GLY7G, PRO11E, PRO11G, PRO14E, PRO14G, PRO20E, PRO20G, PRO23E, PRO23G, PRO26E, PRO26G, PRO29E, PRO29G, PRO2E, PRO2G, PRO5E, PRO5G, PRO8E, PRO8G, THR18E, THR18G
• F-G: ARG15F, ARG15G, ARG17F, ARG17G, GLY10F, GLY10G, GLY13F, GLY13G, GLY16F, GLY16G, GLY19F, GLY19G, GLY1F, GLY1G, GLY22F, GLY22G, GLY25F, GLY25G, GLY28F, GLY28G, GLY4F, GLY4G, GLY7F, GLY7G, PRO11F, PRO11G, PRO14F, PRO14G, PRO20F, PRO20G, PRO23F, PRO23G, PRO26F, PRO26G, PRO29F, PRO29G, PRO2F, PRO2G, PRO5F, PRO5G, PRO8F, PRO8G, THR18F, THR18G
• H-I: ARG15H, ARG15I, ARG17H, ARG17I, GLY10H, GLY10I, GLY13H, GLY13I, GLY16H, GLY16I, GLY19H, GLY19I, GLY1H, GLY1I, GLY22H, GLY22I, GLY25H, GLY25I, GLY28H, GLY28I, GLY4H, GLY4I, GLY7H, GLY7I, PRO11H, PRO11I, PRO14H, PRO14I, PRO20H, PRO20I, PRO23H, PRO23I, PRO26H, PRO26I, PRO29H, PRO29I, PRO2H, PRO2I, PRO5H, PRO5I, PRO8H, PRO8I, THR18H, THR18I
• H-J: ARG15H, ARG15J, ARG17H, ARG17J, GLY10H, GLY10J, GLY13H, GLY13J, GLY16H, GLY16J, GLY19H, GLY19J, GLY1H, GLY1J, GLY22H, GLY22J, GLY25H, GLY25J, GLY28H, GLY28J, GLY4H, GLY4J, GLY7H, GLY7J, PRO11H, PRO11J, PRO14H, PRO14J, PRO20H, PRO20J, PRO23H, PRO23J, PRO26H, PRO26J, PRO29H, PRO2H, PRO2J, PRO5H, PRO5J, PRO8H, PRO8J, THR18H, THR18J
• I-J: ARG15I, ARG15J, ARG17I, ARG17J, GLY10I, GLY10J, GLY13I, GLY13J, GLY16I, GLY16J, GLY19I, GLY19J, GLY1I, GLY1J, GLY22I, GLY22J, GLY25I, GLY25J, GLY28I, GLY28J, GLY4I, GLY4J, GLY7I, GLY7J, PRO11I, PRO11J, PRO14I, PRO14J, PRO20I, PRO20J, PRO23I, PRO23J, PRO26I, PRO26J, PRO29I, PRO2I, PRO2J, PRO5I, PRO5J, PRO8I, PRO8J, THR18I, THR18J