3N95

crystal structure of human crfr2 alpha extracellular domain in complex with urocortin 2

• Total interactions analyzed: 15
• Total true interactions: 6
• Strongest Interaction:
  • Chains: D-F
  • Int. Res.: 67
  • Norm. En. per Res.: -2.4852
• Hub Node: A(2)

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	-12.94	5.4233	-33.3609	-40.8776	21	2	0	1277	0	13	14
A-C	-19.7829	68.1646	-319.278	-270.8963	176	10	17	14141	3	31	37
B-C	0.0	24.9218	-35.5374	-10.6156	44	3	0	2080	0	37	46
B-D	-9.073	67.5411	-311.911	-253.4428	175	14	17	14298	3	33	39
C-E	-17.1138	18.1479	-153.491	-152.4569	74	5	7	7019	0	10	10
D-F	-27.3554	-2.0562	-137.1	-166.5117	67	6	7	6926	0	10	11

Interface residues

• A-B: ALA-286A, ASP-283A, ASP-288A, ASP-340B, GLN-284A, GLU-342B, GLU-89A, GLU-96A, GLY-338B, ILE-337B, LYS-287A, LYS-336B, LYS-341B, LYS-344B, LYS-345B, LYS-93A, PHE-285A, PHE-343B, PRO-289A, THR-290A, THR-339B
• A-C: 0.63839CB6.5876, 5LYSCBLYS-195C, ALA-101A, ALA-182C, ALA-184C, ALA-1C, ALA-202C, ALA-28A, ALA-2A, ALA-32A, ALA-6A, ALA0A, ALA0C, ALA12A, ALA12C, ALA17A, ALA17C, ALA19A, ALA19C, ALA3A, ALA3C, ALA4A, ALA4C, ALA55C, ALA56A, ALA56C, ALA58C, ALA90C, ARG-272C, ARG53A, ARG53C, ARG81C, ASN-185C, ASN-197C, ASN-270A, ASN-3A, ASN-3C, ASN13A, ASN13C, ASN41A, ASN41C, ASN86A, ASN86C, ASP-12C, ASP-186C, ASP-190A, ASP-190C, ASP-193A, ASP-193C, ASP-315A, ASP-7A, ASP-7C, ASP25A, ASP25C, ASP32A, CYS14A, CYS14C, CYS40A, CYS40C, CYS83C, GLN-298A, GLN-35A, GLN-5A, GLN-5C, GLU-11C, GLU-198C, GLU-366A, GLU11A, GLU11C, GLU1A, GLU1C, GLU20A, GLU20C, GLU21A, GLU21C, GLU34A, GLU85A, GLU85C, GLY-183C, GLY-188C, GLY-196C, GLY-204C, GLY-205C, GLY-269C, GLY-301A, GLY-302A, GLY-316A, GLY26A, GLY26C, GLY28A, GLY35A, GLY57C, GLY87A, GLY87C, HIS7A, HIS7C, ILE-192A, ILE-368A, ILE-37A, LEU-9C, LEU10A, LEU10C, LEU16A, LEU16C, LEU18A, LEU18C, LEU22A, LEU22C, LEU23A, LEU23C, LEU24A, LEU24C, LEU31A, LEU44A, LEU5A, LEU5C, LEU6A, LEU6C, LEU84A, LEU84C, LEU9A, LEU9C, LYS-181C, LYS-191A, LYS-191C, LYS-195A, LYS-195C, LYS-200C, LYS-369A, LYS-8A, LYS-8C, MET-34A, PHE-201A, PHE-31A, PHE2A, PHE2C, PRO-36A, PRO-99A, PRO29A, PRO30A, PRO33A, SER-33A, SER15A, SER15C, SER38A, SER38C, SER8A, SER8C, SER91A, SER91C, THR-317A, THR-4A, THR-4C, THR42A, THR42C, THR43A, THR88A, THR88C, TRP-30A, TRP27A, TRP89A, TRP89C, TYR-194A, TYR-199C, TYR-203C, TYR-271A, TYR-29A, TYR37A, TYR37C, TYR39A, TYR39C, VAL-187A, VAL-187C, VAL-189A, VAL-189C, VAL-27A
• B-C: ALA-52B, ALA-58B, ARG-54B, ASN-129B, ASN-88C, ASP-134B, ASP-288C, ASP-340C, ASP-56B, ASP-83B, GLU-366C, GLU-60B, GLU-61B, GLU-79B, GLU-82C, GLU-89C, GLU-92C, GLU-96C, GLY-338C, GLY-365C, ILE-337C, LEU-59B, LEU-95C, LYS-131B, LYS-251B, LYS-282C, LYS-287C, LYS-336C, LYS-341C, LYS-344C, LYS-364C, LYS-57B, LYS-75B, LYS-93C, PHE-285C, PHE-343C, PRO-289C, PRO-55B, SER-64C, THR-133B, THR-290C, THR-339C, TYR-63B, TYR-87C
• B-D: ALA-182D, ALA-184D, ALA-1D, ALA-202B, ALA-202D, ALA-28B, ALA-2B, ALA-32B, ALA-6B, ALA0B, ALA0D, ALA12B, ALA12D, ALA17B, ALA17D, ALA19B, ALA19D, ALA3B, ALA3D, ALA4B, ALA4D, ALA55D, ALA56B, ALA56D, ALA58D, ALA90D, ARG-272D, ARG53B, ARG53D, ARG81D, ASN-185D, ASN-197D, ASN-270B, ASN-270D, ASN-3B, ASN-3D, ASN13B, ASN13D, ASN41B, ASN41D, ASN86B, ASN86D, ASP-12D, ASP-186D, ASP-190B, ASP-190D, ASP-193B, ASP-193D, ASP-315B, ASP-7B, ASP-7D, ASP25B, ASP25D, ASP32B, CYS14B, CYS14D, CYS40B, CYS40D, CYS83D, GLN-298B, GLN-35B, GLN-5B, GLN-5D, GLU-11D, GLU-198D, GLU-366B, GLU11B, GLU11D, GLU1B, GLU1D, GLU20B, GLU20D, GLU21B, GLU21D, GLU34B, GLU85B, GLU85D, GLY-188D, GLY-196D, GLY-204D, GLY-205D, GLY-269D, GLY-301B, GLY-302B, GLY-316B, GLY26B, GLY26D, GLY28B, GLY35B, GLY57D, GLY87B, GLY87D, HIS7B, HIS7D, ILE-192B, ILE-368B, ILE-37B, LEU-9D, LEU10B, LEU10D, LEU16B, LEU16D, LEU18B, LEU18D, LEU22B, LEU22D, LEU23B, LEU23D, LEU24B, LEU24D, LEU31B, LEU44D, LEU5B, LEU5D, LEU6B, LEU6D, LEU84B, LEU84D, LEU9B, LEU9D, LYS-181D, LYS-191B, LYS-191D, LYS-195B, LYS-195D, LYS-200D, LYS-268D, LYS-369B, LYS-8D, LYS-97B, MET-34B, PHE-201B, PHE-31B, PHE2B, PHE2D, PRO-36B, PRO-99B, PRO29B, PRO30B, PRO33B, SER-33B, SER15B, SER15D, SER38B, SER38D, SER8B, SER8D, SER91B, SER91D, THR-317B, THR-4B, THR-4D, THR42B, THR42D, THR43B, THR88B, THR88D, TRP-30B, TRP27B, TRP89B, TRP89D, TYR-194B, TYR-199D, TYR-203D, TYR-271B, TYR-29B, TYR37B, TYR37D, TYR39B, TYR39D, VAL-187B, VAL-187D, VAL-189B, VAL-189D, VAL-27B
• C-E: ALA-101C, ALA-102C, ALA-299C, ALA-318C, ALA-319C, ALA-32C, ALA26E, ALA27E, ALA31E, ALA35E, ALA39E, ALA79C, ARG-304C, ARG28E, ARG36E, ARG40E, ARG81C, ASN34E, ASN69C, ASN94C, ASP-315C, ASP45C, CYS64C, CYS98C, GLN-298C, GLN-321C, GLN30E, GLN46C, GLN97C, GLU-325C, GLU-326C, GLU29E, GLU99C, GLY-296C, GLY-301C, GLY-316C, GLY48C, GLY70C, ILE101C, ILE37E, ILE47C, ILE93C, LEU-294C, LEU-295C, LEU102C, LEU38E, LYS-268C, LYS-324C, LYS-328C, LYS72C, LYS92C, PHE-323C, PHE68C, PRO-322C, PRO-36C, PRO100C, PRO65C, SER-297C, SER-33C, SER91C, SER96C, THR-317C, THR32E, THR33E, THR49C, TRP51C, TYR-29C, TYR-300C, TYR67C, TYR73C, TYR95C, VAL-320C, VAL41E, VAL71C
• D-F: ALA-299D, ALA-318D, ALA-319D, ALA-32D, ALA26F, ALA27F, ALA31F, ALA35F, ALA39F, ALA79D, ARG28F, ARG36F, ARG40F, ARG81D, ASN34F, ASN69D, ASN94D, ASP103D, ASP45D, CYS64D, CYS98D, GLN-298D, GLN-321D, GLN30F, GLN46D, GLN97D, GLU-325D, GLU29F, GLU99D, GLY-296D, GLY-301D, GLY-316D, GLY48D, GLY70D, ILE101D, ILE37F, ILE47D, ILE93D, LEU-295D, LEU102D, LEU38F, LYS-324D, LYS-328D, LYS72D, LYS92D, PHE-323D, PHE68D, PRO-322D, PRO100D, PRO65D, SER-297D, SER-33D, SER91D, SER96D, THR-317D, THR32F, THR33F, THR49D, TRP51D, TYR-29D, TYR-300D, TYR67D, TYR73D, TYR95D, VAL-320D, VAL41F, VAL71D