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2Y6C

The Discovery of MMP7 inhibitors Exploiting a Novel Selectivity Trigger

Functional Information from GO Data
ChainGOidnamespacecontents
A0004222molecular_functionmetalloendopeptidase activity
A0006508biological_processproteolysis
A0008237molecular_functionmetallopeptidase activity
A0008270molecular_functionzinc ion binding
A0031012cellular_componentextracellular matrix
Functional Information from PDB Data
site_idAC1
Number of Residues6
DetailsBINDING SITE FOR RESIDUE CA A 1264
ChainResidue
AASP158
AGLY190
AGLY192
AASP194
AHOH2036
AHOH2052

site_idAC2
Number of Residues6
DetailsBINDING SITE FOR RESIDUE CA A 1265
ChainResidue
ATHR180
AASP198
AGLU201
AASP175
AGLY176
AGLY178

site_idAC3
Number of Residues4
DetailsBINDING SITE FOR RESIDUE ZN A 1266
ChainResidue
AHIS168
AASP170
AHIS183
AHIS196

site_idAC4
Number of Residues4
DetailsBINDING SITE FOR RESIDUE ZN A 1267
ChainResidue
AHIS219
AHIS223
AHIS229
ATQI1269

site_idAC5
Number of Residues7
DetailsBINDING SITE FOR RESIDUE SO4 A 1268
ChainResidue
AALA167
AHIS168
AGLY169
AASP170
ALEU181
AILE211
ATYR241

site_idAC6
Number of Residues13
DetailsBINDING SITE FOR RESIDUE TQI A 1269
ChainResidue
ALEU181
AALA182
AHIS183
AALA184
AALA216
AHIS219
AGLU220
AHIS223
AHIS229
APRO239
ATYR241
AZN1267
AHOH2079

Functional Information from PROSITE/UniProt
site_idPS00142
Number of Residues10
DetailsZINC_PROTEASE Neutral zinc metallopeptidases, zinc-binding region signature. AATHELGHSL
ChainResidueDetails
AALA216-LEU225

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues1
DetailsACT_SITE:
ChainResidueDetails
AGLU220

site_idSWS_FT_FI2
Number of Residues17
DetailsBINDING:
ChainResidueDetails
AASP158
AGLY192
AASP194
AHIS196
AASP198
AGLU201
AHIS219
AHIS223
AHIS229
AHIS168
AASP170
AASP175
AGLY176
AGLY178
ATHR180
AHIS183
AGLY190

218853

PDB entries from 2024-04-24

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