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2R5D

Structure of the gp41 N-trimer in complex with the HIV entry inhibitor PIE7

Functional Information from PDB Data
site_idAC1
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ACE H 0
ChainResidue
HDLY1
HGLY2
HDAS5
HDTY6
HHOH42

site_idAC2
Number of Residues5
DetailsBINDING SITE FOR RESIDUE NH2 H 16
ChainResidue
HHOH34
HDLE12
HDCY13
HDAL14
HDAL15

site_idAC3
Number of Residues2
DetailsBINDING SITE FOR RESIDUE ACE K 0
ChainResidue
KDLY1
KGLY2

site_idAC4
Number of Residues6
DetailsBINDING SITE FOR RESIDUE NH2 K 16
ChainResidue
BLEU32
BHOH470
KDLE12
KDCY13
KDAL14
KDAL15

site_idAC5
Number of Residues4
DetailsBINDING SITE FOR RESIDUE ACE L 0
ChainResidue
BGLU6
BGLU10
BEPE430
LDLY1

site_idAC6
Number of Residues6
DetailsBINDING SITE FOR RESIDUE NH2 L 16
ChainResidue
CLEU32
LDLE12
LDCY13
LDAL14
LDAL15
LHOH25

site_idAC7
Number of Residues5
DetailsBINDING SITE FOR RESIDUE SO4 B 47
ChainResidue
ALYS27
BARG25
BHOH457
BHOH468
KHOH17

site_idAC8
Number of Residues14
DetailsBINDING SITE FOR RESIDUE EPE B 430
ChainResidue
AALA42
AARG43
ALEU45
ANH246
BACE0
BARG1
BMET2
BLYS3
BGLU6
BHOH436
BHOH469
CARG1
LACE0
LDLY1

site_idAC9
Number of Residues8
DetailsBINDING SITE FOR RESIDUE GOL A 47
ChainResidue
ALEU40
AARG43
AILE44
AHOH74
CGLN41
CILE44
CLEU45
HHOH17

site_idBC1
Number of Residues24
DetailsBINDING SITE FOR CHAIN H OF HIV ENTRY INHIBITOR PIE7
ChainResidue
ALEU29
ALEU32
ATRP35
AGLY36
AGLN39
CILE37
CLYS38
CGLN41
HACE0
HNH216
HHOH17
HHOH18
HHOH19
HHOH20
HHOH21
HHOH22
HHOH24
HHOH25
HHOH27
HHOH28
HHOH30
HHOH33
HHOH35
HHOH38

site_idBC2
Number of Residues25
DetailsBINDING SITE FOR CHAIN K OF HIV ENTRY INHIBITOR PIE7
ChainResidue
KHOH22
KHOH23
KHOH25
KHOH29
KHOH31
AVAL34
ALYS38
AGLN41
BLEU32
BTRP35
BLEU40
BHOH455
CGLU20
CASN21
CALA24
CHOH62
CHOH75
CHOH83
KACE0
KNH216
KHOH17
KHOH18
KHOH19
KHOH20
KHOH21

site_idBC3
Number of Residues21
DetailsBINDING SITE FOR CHAIN L OF HIV ENTRY INHIBITOR PIE7
ChainResidue
BVAL34
BLYS38
BGLN41
BEPE430
CLEU29
CLEU32
CTRP35
LACE0
LNH216
LHOH17
LHOH18
LHOH19
LHOH20
LHOH21
LHOH22
LHOH23
LHOH24
LHOH28
LHOH29
LHOH30
LHOH31

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PDB entries from 2024-10-30

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