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6C1W

A tethered niacin-derived pincer complex with a nickel-carbon or sulfite-carbon bond in lactate racemase

Functional Information from GO Data
ChainGOidnamespacecontents
A0016853molecular_functionisomerase activity
A0046872molecular_functionmetal ion binding
A0050043molecular_functionlactate racemase activity
B0016853molecular_functionisomerase activity
B0046872molecular_functionmetal ion binding
B0050043molecular_functionlactate racemase activity
C0016853molecular_functionisomerase activity
C0046872molecular_functionmetal ion binding
C0050043molecular_functionlactate racemase activity
Functional Information from PDB Data
site_idAC1
Number of Residues21
Detailsbinding site for residue ENJ A 501
ChainResidue
ASER71
APHE176
ASER180
AGLY181
ALYS184
APRO188
AGLY189
AHIS200
ATYR294
ALYS298
ANI502
AASP72
AHOH606
AHOH616
ATHR74
AARG75
AALA104
APHE107
AHIS108
APHE170
AHIS174

site_idAC2
Number of Residues3
Detailsbinding site for residue NI A 502
ChainResidue
APRO188
AHIS200
AENJ501

site_idAC3
Number of Residues4
Detailsbinding site for residue SO4 A 503
ChainResidue
AARG109
AASN292
AASP321
AHIS323

site_idAC4
Number of Residues3
Detailsbinding site for residue SO4 A 504
ChainResidue
ASER38
AGLU39
ALYS246

site_idAC5
Number of Residues2
Detailsbinding site for residue SO4 A 505
ChainResidue
ASER207
APRO208

site_idAC6
Number of Residues2
Detailsbinding site for residue SO4 A 506
ChainResidue
AHIS217
ALYS222

site_idAC7
Number of Residues4
Detailsbinding site for residue NI B 502
ChainResidue
BPRO188
BHIS200
B4EY501
BSO4503

site_idAC8
Number of Residues8
Detailsbinding site for residue SO4 B 503
ChainResidue
BARG75
BHIS108
BHIS174
BTYR294
BGLN295
BLYS298
B4EY501
BNI502

site_idAC9
Number of Residues2
Detailsbinding site for residue SO4 B 504
ChainResidue
BLYS10
BARG320

site_idAD1
Number of Residues4
Detailsbinding site for residue SO4 B 505
ChainResidue
BSER38
BGLU39
BLYS246
BHOH628

site_idAD2
Number of Residues2
Detailsbinding site for residue SO4 B 506
ChainResidue
BSER149
BARG350

site_idAD3
Number of Residues2
Detailsbinding site for residue SO4 B 507
ChainResidue
BPRO349
BARG350

site_idAD4
Number of Residues2
Detailsbinding site for residue SO4 B 508
ChainResidue
BHIS217
BLYS222

site_idAD5
Number of Residues2
Detailsbinding site for residue SO4 B 509
ChainResidue
BARG11
BTHR12

site_idAD6
Number of Residues1
Detailsbinding site for residue SO4 B 510
ChainResidue
BARG98

site_idAD7
Number of Residues3
Detailsbinding site for residue NI C 502
ChainResidue
CPRO188
CHIS200
C4EY501

site_idAD8
Number of Residues7
Detailsbinding site for residue SO3 C 503
ChainResidue
CARG75
CHIS108
CHIS174
CTYR294
CGLN295
CLYS298
C4EY501

site_idAD9
Number of Residues2
Detailsbinding site for residue SO4 C 504
ChainResidue
ALYS194
CARG320

site_idAE1
Number of Residues3
Detailsbinding site for residue SO4 C 505
ChainResidue
CSER38
CGLU39
CLYS246

site_idAE2
Number of Residues1
Detailsbinding site for residue SO4 C 506
ChainResidue
CARG350

site_idAE3
Number of Residues3
Detailsbinding site for residue SO4 C 507
ChainResidue
CPRO349
CARG350
CLEU351

site_idAE4
Number of Residues26
Detailsbinding site for Di-peptide 4EY B 501 and LYS B 184
ChainResidue
BPRO188
BGLY189
BHIS200
BTRP358
BNI502
BSO4503
BHOH601
BHOH605
BSER71
BASP72
BTHR74
BARG75
BALA104
BPHE107
BHIS108
BPHE170
BHIS174
BPHE176
BALA177
BSER180
BGLY181
BGLY182
BARG183
BSER185
BVAL186
BLEU187

site_idAE5
Number of Residues25
Detailsbinding site for Di-peptide 4EY C 501 and LYS C 184
ChainResidue
CSER71
CASP72
CTHR74
CARG75
CALA104
CPHE107
CHIS108
CHIS174
CPHE176
CSER180
CGLY181
CGLY182
CARG183
CSER185
CVAL186
CLEU187
CPRO188
CGLY189
CHIS200
CTYR294
CTRP358
CNI502
CSO3503
CHOH605
CHOH608

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues6
DetailsACT_SITE: Proton donor/acceptor => ECO:0000305|PubMed:26138974
ChainResidueDetails
AHIS108
AHIS174
BHIS108
BHIS174
CHIS108
CHIS174

site_idSWS_FT_FI2
Number of Residues6
DetailsBINDING: BINDING => ECO:0000269|PubMed:26138974
ChainResidueDetails
AASP72
AHIS200
BASP72
BHIS200
CASP72
CHIS200

site_idSWS_FT_FI3
Number of Residues3
DetailsBINDING: covalent => ECO:0000269|PubMed:26138974, ECO:0000269|PubMed:27114550
ChainResidueDetails
ALYS184
BLYS184
CLYS184

site_idSWS_FT_FI4
Number of Residues6
DetailsBINDING: BINDING => ECO:0000305|PubMed:26138974
ChainResidueDetails
AGLN295
ALYS298
BGLN295
BLYS298
CGLN295
CLYS298

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PDB entries from 2024-07-31

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